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

Details

Stereochemistry RACEMIC
Molecular Formula C24H31N7O2
Molecular Weight 449.5486
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-Cyclopentyl-6-(1-hydroxyethyl)-5-methyl-2-[[5-(1-piperazinyl)-2-pyridinyl]amino]pyrido[2,3-d]pyrimidin-7(8H)-one

SMILES

CC(O)C1=C(C)C2=C(N=C(NC3=NC=C(C=C3)N4CCNCC4)N=C2)N(C5CCCC5)C1=O

InChI

InChIKey=ITWDCYAGRFOAOD-UHFFFAOYSA-N
InChI=1S/C24H31N7O2/c1-15-19-14-27-24(28-20-8-7-18(13-26-20)30-11-9-25-10-12-30)29-22(19)31(17-5-3-4-6-17)23(33)21(15)16(2)32/h7-8,13-14,16-17,25,32H,3-6,9-12H2,1-2H3,(H,26,27,28,29)

HIDE SMILES / InChI

Molecular Formula C24H31N7O2
Molecular Weight 449.5486
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:29:43 GMT 2025
Edited
by admin
on Wed Apr 02 17:29:43 GMT 2025
Record UNII
7WNE62J4FE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Pyrido[2,3-d]pyrimidin-7(8H)-one, 8-cyclopentyl-6-(1-hydroxyethyl)-5-methyl-2-[[5-(1-piperazinyl)-2-pyridinyl]amino]-
Preferred Name English
8-Cyclopentyl-6-(1-hydroxyethyl)-5-methyl-2-[[5-(1-piperazinyl)-2-pyridinyl]amino]pyrido[2,3-d]pyrimidin-7(8H)-one
Systematic Name English
Code System Code Type Description
PUBCHEM
69082340
Created by admin on Wed Apr 02 17:29:43 GMT 2025 , Edited by admin on Wed Apr 02 17:29:43 GMT 2025
PRIMARY
CAS
1376615-91-6
Created by admin on Wed Apr 02 17:29:43 GMT 2025 , Edited by admin on Wed Apr 02 17:29:43 GMT 2025
PRIMARY
FDA UNII
7WNE62J4FE
Created by admin on Wed Apr 02 17:29:43 GMT 2025 , Edited by admin on Wed Apr 02 17:29:43 GMT 2025
PRIMARY