3-[2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
Chemical Structure Depiction of
3-[2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
3-[2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
Compound characteristics
| Compound ID: | K284-3722 |
| Compound Name: | 3-[2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide |
| Molecular Weight: | 546.05 |
| Molecular Formula: | C28 H24 Cl N5 O3 S |
| Smiles: | C(CN1C(=Nc2ccccc2C1=O)SCC1=CC(N2C=C(C=CC2=N1)[Cl])=O)C(NCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3744 |
| logD: | 2.3744 |
| logSw: | -3.5673 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.568 |
| InChI Key: | WBUJZMWQURIUNC-UHFFFAOYSA-N |