TELAGLENASTAT HYDROCHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H24F3N7O3S.ClH
Molecular Weight	608.035
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of TELAGLENASTAT HYDROCHLORIDE

Structure Search

SMILES

Cl.FC(F)(F)OC1=CC(CC(=O)NC2=NN=C(CCCCC3=NN=C(NC(=O)CC4=NC=CC=C4)S3)C=C2)=CC=C1

InChI

InChIKey=NMVMURBPQFKTAX-UHFFFAOYSA-N

InChI=1S/C26H24F3N7O3S.ClH/c27-26(28,29)39-20-9-5-6-17(14-20)15-22(37)31-21-12-11-18(33-34-21)7-1-2-10-24-35-36-25(40-24)32-23(38)16-19-8-3-4-13-30-19;/h3-6,8-9,11-14H,1-2,7,10,15-16H2,(H,31,34,37)(H,32,36,38);1H

HIDE SMILES / InChI

Molecular Formula	C26H24F3N7O3S
Molecular Weight	571.574
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Glutaminase kidney isoform, mitochondrial 4 Target ID: CHEMBL2146302 Sources: https://www.ncbi.nlm.nih.gov/pubmed/26988803	Inhibitor 8297		180.0 nM [IC50]

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:46:31 GMT 2023` Edited by `admin` on `Sat Dec 16 09:46:31 GMT 2023`
Record UNII	B33561JJ61
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TELAGLENASTAT HYDROCHLORIDE

Official Name

English

TELAGLENASTAT HYDROCHLORIDE [USAN]

Common Name

English

CB-839 HYDROCHLORIDE

Code

English

2-PYRIDINEACETAMIDE, N-(5-(4-(6-((2-(3-(TRIFLUOROMETHOXY)PHENYL)ACETYL)AMINO)-3-PYRIDAZINYL)BUTYL)-1,3,4-THIADIAZOL-2-YL)-, HYDROCHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

CAS

1874231-60-3