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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H13Br2N3O
Molecular Weight 387.07
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,6-Dibromo-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7(8H)-one

SMILES

CC1=C(Br)C(=O)N(C2CCCC2)C3=C1C=NC(Br)=N3

InChI

InChIKey=GDBOCEQMRZFVCK-UHFFFAOYSA-N
InChI=1S/C13H13Br2N3O/c1-7-9-6-16-13(15)17-11(9)18(12(19)10(7)14)8-4-2-3-5-8/h6,8H,2-5H2,1H3

HIDE SMILES / InChI

Molecular Formula C13H13Br2N3O
Molecular Weight 387.07
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 17:29:43 GMT 2025
Edited
by admin
on Wed Apr 02 17:29:43 GMT 2025
Record UNII
XEZ76VA5A7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,6-Dibromo-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7(8H)-one
Systematic Name English
Pyrido[2,3-d]pyrimidin-7(8H)-one, 2,6-dibromo-8-cyclopentyl-5-methyl-
Preferred Name English
Code System Code Type Description
PUBCHEM
78357942
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
EPA CompTox
DTXSID801156339
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
1415560-29-0
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
XEZ76VA5A7
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