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

Details

Stereochemistry ACHIRAL
Molecular Formula C25H29N7O3
Molecular Weight 475.5429
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PALBOCICLIB N-FORMYL IMPURITY

SMILES

CC(=O)C1=C(C)C2=C(N=C(NC3=NC=C(C=C3)N4CCN(CC4)C=O)N=C2)N(C5CCCC5)C1=O

InChI

InChIKey=KVICSWHDXLNVAO-UHFFFAOYSA-N
InChI=1S/C25H29N7O3/c1-16-20-14-27-25(28-21-8-7-19(13-26-21)31-11-9-30(15-33)10-12-31)29-23(20)32(18-5-3-4-6-18)24(35)22(16)17(2)34/h7-8,13-15,18H,3-6,9-12H2,1-2H3,(H,26,27,28,29)

HIDE SMILES / InChI

Approval Year

Name Type Language
PALBOCICLIB N-FORMYL IMPURITY
Common Name English
1-PIPERAZINECARBOXALDEHYDE, 4-(6-((6-ACETYL-8-CYCLOPENTYL-7,8-DIHYDRO-5-METHYL-7-OXOPYRIDO(2,3-D)PYRIMIDIN-2-YL)AMINO)-3-PYRIDINYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
NJB3FNK33C
Created by admin on Sat Dec 16 19:11:12 GMT 2023 , Edited by admin on Sat Dec 16 19:11:12 GMT 2023
PRIMARY
PUBCHEM
154634180
Created by admin on Sat Dec 16 19:11:12 GMT 2023 , Edited by admin on Sat Dec 16 19:11:12 GMT 2023
PRIMARY
CAS
2174002-16-3
Created by admin on Sat Dec 16 19:11:12 GMT 2023 , Edited by admin on Sat Dec 16 19:11:12 GMT 2023
PRIMARY