3-[(4-fluorophenyl)methyl]-2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}pyrido[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(4-fluorophenyl)methyl]-2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}pyrido[2,3-d]pyrimidin-4(3H)-one
3-[(4-fluorophenyl)methyl]-2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}pyrido[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C724-0121 |
| Compound Name: | 3-[(4-fluorophenyl)methyl]-2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}pyrido[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 445.47 |
| Molecular Formula: | C23 H16 F N5 O2 S |
| Smiles: | C(c1ccc(cc1)F)N1C(=Nc2c(cccn2)C1=O)SCC1=CC(N2C=CC=CC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9089 |
| logD: | 2.9088 |
| logSw: | -3.5107 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.381 |
| InChI Key: | XWXPZENXAQWCLO-UHFFFAOYSA-N |