PF- 06895751

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H21FN6O3
Molecular Weight	424.4282
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CNCC1=NN(C)C(C#N)=C1C2=CN=C(N)C(O[C@H](C)C3=C(C=CC(F)=C3)C(O)=O)=C2

InChI

InChIKey=IFEPJAKXCDYTOK-LLVKDONJSA-N

InChI=1S/C21H21FN6O3/c1-11(15-7-13(22)4-5-14(15)21(29)30)31-18-6-12(9-26-20(18)24)19-16(10-25-2)27-28(3)17(19)8-23/h4-7,9,11,25H,10H2,1-3H3,(H2,24,26)(H,29,30)/t11-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H21FN6O3
Molecular Weight	424.4282
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 02:08:44 GMT 2025` Edited by `admin` on `Wed Apr 02 02:08:44 GMT 2025`
Record UNII	FSA26J9M8B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

LORLATINIB BENZOIC ACID METABOLITE (M8)

Preferred Name

English

PF- 06895751

Code

English

LORLATINIB METABOLITE (LORLATINIB BENZOIC ACID METABOLITE-M8)

Common Name

English

BENZOIC ACID, 2-((1R)-1-((2-AMINO-5-(5-CYANO-1-METHYL-3-((METHYLAMINO)METHYL)-1H-PYRAZOL-4-YL)-3-PYRIDINYL)OXY)ETHYL)-4-FLUORO-

Systematic Name

English

Code System Code Type Description

PUBCHEM

89816280

Created by admin on Wed Apr 02 02:08:44 GMT 2025 , Edited by admin on Wed Apr 02 02:08:44 GMT 2025

PRIMARY

CAS

1455009-85-4

Created by admin on Wed Apr 02 02:08:44 GMT 2025 , Edited by admin on Wed Apr 02 02:08:44 GMT 2025

PRIMARY

FDA UNII

FSA26J9M8B

Created by admin on Wed Apr 02 02:08:44 GMT 2025 , Edited by admin on Wed Apr 02 02:08:44 GMT 2025

PRIMARY

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