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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H32N6O
Molecular Weight 420.5505
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GSK-812397

SMILES

CN(CC1=C(CO)N2C(C=CC=C2N3CCN(C)CC3)=N1)[C@H]4CCCC5=C4N=CC=C5

InChI

InChIKey=QUDMHFVRKBVGBY-FQEVSTJZSA-N
InChI=1S/C24H32N6O/c1-27-12-14-29(15-13-27)23-10-4-9-22-26-19(21(17-31)30(22)23)16-28(2)20-8-3-6-18-7-5-11-25-24(18)20/h4-5,7,9-11,20,31H,3,6,8,12-17H2,1-2H3/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H32N6O
Molecular Weight 420.5505
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Blockade of X4-tropic HIV-1 cellular entry by GSK812397, a potent noncompetitive CXCR4 receptor antagonist.
2010 Feb
Substance Class Chemical
Created
by admin
on Sat Dec 16 18:26:20 GMT 2023
Edited
by admin
on Sat Dec 16 18:26:20 GMT 2023
Record UNII
966F77521M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GSK-812397
Common Name English
IMIDAZO(1,2-A)PYRIDINE-3-METHANOL, 5-(4-METHYL-1-PIPERAZINYL)-2-((METHYL((8S)-5,6,7,8-TETRAHYDRO-8-QUINOLINYL)AMINO)METHYL)-
Systematic Name English
(5-(4-METHYL-1-PIPERAZINYL)-2-((METHYL((8S)-5,6,7,8-TETRAHYDRO-8-QUINOLINYL)AMINO)METHYL)IMIDAZO(1,2-A)PYRIDIN-3-YL)METHANOL
Systematic Name English
Code System Code Type Description
FDA UNII
966F77521M
Created by admin on Sat Dec 16 18:26:20 GMT 2023 , Edited by admin on Sat Dec 16 18:26:20 GMT 2023
PRIMARY
CAS
878197-98-9
Created by admin on Sat Dec 16 18:26:20 GMT 2023 , Edited by admin on Sat Dec 16 18:26:20 GMT 2023
PRIMARY
PUBCHEM
11718722
Created by admin on Sat Dec 16 18:26:20 GMT 2023 , Edited by admin on Sat Dec 16 18:26:20 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY