5-(2-Fluoro-4-iodophenylamino)-3-(2-hydroxypropyl)-8-methylpyrido[2,3-d]pyrimidine-4,7(3H,8H)-dione

HCID 24967883

Basic information

Standard SMILES
CC(O)Cn1cnc2c(c(Nc3ccc(I)cc3F)cc(=O)n2C)c1=O
InChIKey
KWPIVHUPCLHCGY-UHFFFAOYSA-N
Molecular formula
C17H16FIN4O3
Average molar mass
470.24 g/mol

Names & identifiers

Preferred name
5-(2-Fluoro-4-iodophenylamino)-3-(2-hydroxypropyl)-8-methylpyrido[2,3-d]pyrimidine-4,7(3H,8H)-dione
IUPAC
5-(2-fluoro-4-iodoanilino)-3-(2-hydroxypropyl)-8-methylpyrido[2,3-d]pyrimidine-4,7-dione

Names & synonyms

SCHEMBL1528762CHEMBL3644825BDBM97657KWPIVHUPCLHCGY-UHFFFAOYSA-NUS8470837, 385-(2-Fluoro-4-iodophenylamino)-3-(2-hydroxypropyl)-8-methylpyrido[2,3-d]pyrimidine-4,7(3H,8H)-dione

Database identifiers

PubChem CID
24967883
ChEMBL
CHEMBL3644825

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
85.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
26

Related reactions

4 records

Compound notes

Loading…