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

Details

Stereochemistry ACHIRAL
Molecular Formula C21H22F2N6O2
Molecular Weight 428.4352
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Palacaparib

SMILES

CNC(=O)C1=CC=C(N2CCN(CC3=C(F)C4=C(C=C3)N=C(C)C(=O)N4)CC2)C(F)=N1

InChI

InChIKey=WXRCLFFPZXJCLS-UHFFFAOYSA-N
InChI=1S/C21H22F2N6O2/c1-12-20(30)27-18-14(25-12)4-3-13(17(18)22)11-28-7-9-29(10-8-28)16-6-5-15(21(31)24-2)26-19(16)23/h3-6H,7-11H2,1-2H3,(H,24,31)(H,27,30)

HIDE SMILES / InChI

Molecular Formula C21H22F2N6O2
Molecular Weight 428.4352
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 10:17:11 GMT 2025
Edited
by admin
on Wed Apr 02 10:17:11 GMT 2025
Record UNII
9UG32UQW48
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-PYRIDINECARBOXAMIDE, 6-FLUORO-5-(4-((5-FLUORO-3,4-DIHYDRO-2-METHYL-3-OXO-6-QUINOXALINYL)METHYL)-1-PIPERAZINYL)-N-METHYL-
Preferred Name English
Palacaparib
INN  
Official Name English
AZD-9574
Code English
AZD9574
Code English
palacaparib [INN]
Common Name English
Code System Code Type Description
CAS
2756333-39-6
Created by admin on Wed Apr 02 10:17:11 GMT 2025 , Edited by admin on Wed Apr 02 10:17:11 GMT 2025
PRIMARY
SMS_ID
300000046489
Created by admin on Wed Apr 02 10:17:11 GMT 2025 , Edited by admin on Wed Apr 02 10:17:11 GMT 2025
PRIMARY
INN
13369
Created by admin on Wed Apr 02 10:17:11 GMT 2025 , Edited by admin on Wed Apr 02 10:17:11 GMT 2025
PRIMARY
FDA UNII
9UG32UQW48
Created by admin on Wed Apr 02 10:17:11 GMT 2025 , Edited by admin on Wed Apr 02 10:17:11 GMT 2025
PRIMARY
PUBCHEM
162524593
Created by admin on Wed Apr 02 10:17:11 GMT 2025 , Edited by admin on Wed Apr 02 10:17:11 GMT 2025
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
poly (ADP-ribose) polymerase (PARP) inhibitor, antineoplastic
Related Record Type Details
ACTIVE MOIETY
poly (ADP-ribose) polymerase (PARP) inhibitor, antineoplastic