U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C20H23ClN6O2.ClH
Molecular Weight 451.35
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GSK-2256098 HYDROCHLORIDE

SMILES

Cl.CONC(=O)C1=CC=CC=C1NC2=CC(NC3=CC(C)=NN3C(C)C)=NC=C2Cl

InChI

InChIKey=KWSGTBMHVKYZMA-UHFFFAOYSA-N
InChI=1S/C20H23ClN6O2.ClH/c1-12(2)27-19(9-13(3)25-27)24-18-10-17(15(21)11-22-18)23-16-8-6-5-7-14(16)20(28)26-29-4;/h5-12H,1-4H3,(H,26,28)(H2,22,23,24);1H

HIDE SMILES / InChI

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

Molecular Formula C20H23ClN6O2
Molecular Weight 414.889
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
15.0 nM [IC50]
PubMed

PubMed

TitleDatePubMed
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:36:01 GMT 2023
Edited
by admin
on Sat Dec 16 08:36:01 GMT 2023
Record UNII
4CSJ8BJ597
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GSK-2256098 HYDROCHLORIDE
Code English
BENZAMIDE, 2-((5-CHLORO-2-((3-METHYL-1-(1-METHYLETHYL)-1H-PYRAZOL-5-YL)AMINO)-4-PYRIDINYL)AMINO)-N-METHOXY-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
4CSJ8BJ597
Created by admin on Sat Dec 16 08:36:01 GMT 2023 , Edited by admin on Sat Dec 16 08:36:01 GMT 2023
PRIMARY
PUBCHEM
54589075
Created by admin on Sat Dec 16 08:36:01 GMT 2023 , Edited by admin on Sat Dec 16 08:36:01 GMT 2023
PRIMARY
CAS
1416771-10-2
Created by admin on Sat Dec 16 08:36:01 GMT 2023 , Edited by admin on Sat Dec 16 08:36:01 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY