N-(3-chloro-4-fluorophenyl)-2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}acetamide
N-(3-chloro-4-fluorophenyl)-2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F884-0190 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}acetamide |
| Molecular Weight: | 391.85 |
| Molecular Formula: | C18 H15 Cl F N3 O2 S |
| Smiles: | CC1C=CC2=NC(CSCC(Nc3ccc(c(c3)[Cl])F)=O)=CC(N2C=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3548 |
| logD: | 3.3462 |
| logSw: | -3.6364 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.622 |
| InChI Key: | BCRUXIINSKYVSD-UHFFFAOYSA-N |