N-(2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-3-phenylprop-2-enamide
Chemical Structure Depiction of
N-(2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-3-phenylprop-2-enamide
N-(2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | F880-0506 |
| Compound Name: | N-(2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-3-phenylprop-2-enamide |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C25 H21 N3 O2 S |
| Smiles: | CC1C=CC2=NC(CSc3ccccc3NC(/C=C/c3ccccc3)=O)=CC(N2C=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3472 |
| logD: | 4.3472 |
| logSw: | -4.3503 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.652 |
| InChI Key: | ADWQIQCWDQJRNB-UHFFFAOYSA-N |