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Details

Stereochemistry ACHIRAL
Molecular Formula C20H22ClN3O.2ClH
Molecular Weight 428.783
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GSK-369796 DIHYDROCHLORIDE

SMILES

Cl.Cl.CC(C)(C)NCC1=C(O)C=C(NC2=CC=NC3=CC(Cl)=CC=C23)C=C1

InChI

InChIKey=UDVALKJFXQVZSI-UHFFFAOYSA-N
InChI=1S/C20H22ClN3O.2ClH/c1-20(2,3)23-12-13-4-6-15(11-19(13)25)24-17-8-9-22-18-10-14(21)5-7-16(17)18;;/h4-11,23,25H,12H2,1-3H3,(H,22,24);2*1H

HIDE SMILES / InChI

Approval Year

Name Type Language
GSK-369796 DIHYDROCHLORIDE
Common Name English
DE-0055
Code English
GSK369796 DIHYDROCHLORIDE
Code English
2-((TERT-BUTYLAMINO)METHYL)-5-((7-CHLORO-4-QUINOLYL)AMINO)PHENOL HYDROCHLORIDE
Systematic Name English
5-((7-CHLORO-4-QUINOLINYL)AMINO)-2-(((1,1-DIMETHYLETHYL)AMINO)METHYL)PHENOL DIHYDROCHLORIDE
Systematic Name English
AKOS015994550
Code English
KB-272651
Code English
MOLPORT-009-194-119
Code English
PHENOL, 5-((7-CHLORO-4-QUINOLINYL)AMINO)-2-(((1,1-DIMETHYLETHYL)AMINO)METHYL)-, HYDROCHLORIDE (1:2)
Systematic Name English
Code System Code Type Description
FDA UNII
6W7T5AWQ47
Created by admin on Sat Dec 16 11:29:11 UTC 2023 , Edited by admin on Sat Dec 16 11:29:11 UTC 2023
PRIMARY
MANUFACTURER PRODUCT INFORMATION
GSK-369796
Created by admin on Sat Dec 16 11:29:11 UTC 2023 , Edited by admin on Sat Dec 16 11:29:11 UTC 2023
PRIMARY Quick Overview: Shows antimalerial activity with IC50 values of 11.2 nM for 3D7 strain, 12.6 nM for HB3 strain, 17.6 nM for K1 strain.
PUBCHEM
51071988
Created by admin on Sat Dec 16 11:29:11 UTC 2023 , Edited by admin on Sat Dec 16 11:29:11 UTC 2023
PRIMARY
CAS
1010411-21-8
Created by admin on Sat Dec 16 11:29:11 UTC 2023 , Edited by admin on Sat Dec 16 11:29:11 UTC 2023
PRIMARY