TOLEBRUTINIB

Investigational

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H25N5O3
Molecular Weight	455.5084
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC1=NC=CC2=C1N(C(=O)N2[C@@H]3CCCN(C3)C(=O)C=C)C4=CC=C(OC5=CC=CC=C5)C=C4

InChI

InChIKey=KOEUOFPEZFUWRF-LJQANCHMSA-N

InChI=1S/C26H25N5O3/c1-2-23(32)29-16-6-7-19(17-29)30-22-14-15-28-25(27)24(22)31(26(30)33)18-10-12-21(13-11-18)34-20-8-4-3-5-9-20/h2-5,8-15,19H,1,6-7,16-17H2,(H2,27,28)/t19-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C26H25N5O3
Molecular Weight	455.5084
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

C_max

Value	Dose	Analyte	Population
7.1 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/37642857/	60 mg single, oral dose: 60 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
1.17 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	7.5 mg single, oral dose: 7.5 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
1.96 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	15 mg single, oral dose: 15 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
6.25 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	30 mg single, oral dose: 30 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
8.47 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	60 mg single, oral dose: 60 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
19.3 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	90 mg single, oral dose: 90 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
1.32 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	7.5 mg 1 times / day multiple, oral dose: 7.5 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
2.51 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	15 mg 1 times / day multiple, oral dose: 15 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
7.46 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	30 mg 1 times / day multiple, oral dose: 30 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
6.69 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	60 mg 1 times / day multiple, oral dose: 60 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
21.7 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	90 mg 1 times / day multiple, oral dose: 90 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED

AUC

Value	Dose	Analyte	Population
15.6 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/37642857/	60 mg single, oral dose: 60 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
2.12 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	7.5 mg single, oral dose: 7.5 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
3.82 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	15 mg single, oral dose: 15 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
9.67 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	30 mg single, oral dose: 30 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
24.3 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	60 mg single, oral dose: 60 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
35.5 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	90 mg single, oral dose: 90 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
3.07 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	7.5 mg 1 times / day multiple, oral dose: 7.5 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
5.85 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	15 mg 1 times / day multiple, oral dose: 15 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
14.9 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	30 mg 1 times / day multiple, oral dose: 30 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
18.2 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	60 mg 1 times / day multiple, oral dose: 60 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
56.6 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	90 mg 1 times / day multiple, oral dose: 90 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED

T_1/2

Value	Dose	Analyte	Population
3.61 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/37642857/	60 mg single, oral dose: 60 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
1.45 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	7.5 mg single, oral dose: 7.5 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
1.4 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	15 mg single, oral dose: 15 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
1.6 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	30 mg single, oral dose: 30 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
1.98 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	60 mg single, oral dose: 60 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
2.1 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	90 mg single, oral dose: 90 mg route of administration: Oral experiment type: SINGLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
1.57 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	7.5 mg 1 times / day multiple, oral dose: 7.5 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
1.68 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	15 mg 1 times / day multiple, oral dose: 15 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
2.02 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	30 mg 1 times / day multiple, oral dose: 30 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
2.37 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	60 mg 1 times / day multiple, oral dose: 60 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED
2.83 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	90 mg 1 times / day multiple, oral dose: 90 mg route of administration: Oral experiment type: MULTIPLE co-administered:	TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED

F_unbound

Value	Dose	Co-administered	Analyte	Population
6.5% EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/34724345/	7.5 mg single, oral dose: 7.5 mg route of administration: Oral experiment type: SINGLE co-administered:		TOLEBRUTINIB plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FED

Substance Class	Chemical Created by `admin` on `Wed Apr 02 01:04:31 GMT 2025` Edited by `admin` on `Wed Apr 02 01:04:31 GMT 2025`
Record UNII	8CZ82ZYY9X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PRN-2246

Preferred Name

English

TOLEBRUTINIB

Official Name

English

SAR-442168

Code

English

2H-IMIDAZO(4,5-C)PYRIDIN-2-ONE, 4-AMINO-1,3-DIHYDRO-1-((3R)-1-(1-OXO-2-PROPEN-1-YL)-3-PIPERIDINYL)-3-(4-PHENOXYPHENYL)-

Systematic Name

English

4-AMINO-1,3-DIHYDRO-1-((3R)-1-(1-OXO-2-PROPEN-1-YL)-3-PIPERIDINYL)-3-(4-PHENOXYPHENYL)-2H-IMIDAZO(4,5-C)PYRIDIN-2-ONE

Systematic Name

English

TOLEBRUTINIB [USAN]

Common Name

English

tolebrutinib [INN]

Common Name

English

Tolebrutinib [WHO-DD]

Common Name

English

SAR442168

Code

English

PRN2246

Code

English

Code System Code Type Description

CAS

1971920-73-6