N-(2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-(2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-3,4-dimethoxybenzamide
N-(2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | F880-0323 |
| Compound Name: | N-(2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-3,4-dimethoxybenzamide |
| Molecular Weight: | 481.96 |
| Molecular Formula: | C24 H20 Cl N3 O4 S |
| Smiles: | COc1ccc(cc1OC)C(Nc1ccccc1SCC1=CC(N2C=C(C=CC2=N1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0183 |
| logD: | 3.0183 |
| logSw: | -3.7058 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.127 |
| InChI Key: | GIUKTIHFLDGUKT-UHFFFAOYSA-N |