2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-7-(4-methylphenyl)-5-phenylpyrido[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-7-(4-methylphenyl)-5-phenylpyrido[2,3-d]pyrimidin-4(3H)-one
2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-7-(4-methylphenyl)-5-phenylpyrido[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C202-0134 |
| Compound Name: | 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-7-(4-methylphenyl)-5-phenylpyrido[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 487.98 |
| Molecular Formula: | C27 H19 Cl F N3 O S |
| Smiles: | Cc1ccc(cc1)c1cc(c2ccccc2)c2C(NC(=Nc2n1)SCc1ccc(cc1[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.8976 |
| logD: | 7.75 |
| logSw: | -6.5002 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.15 |
| InChI Key: | QOXHUJCIBCKSNW-UHFFFAOYSA-N |