N-(2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)furan-2-carboxamide
Chemical Structure Depiction of
N-(2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)furan-2-carboxamide
N-(2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)furan-2-carboxamide
Compound characteristics
| Compound ID: | F880-0437 |
| Compound Name: | N-(2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)furan-2-carboxamide |
| Molecular Weight: | 391.45 |
| Molecular Formula: | C21 H17 N3 O3 S |
| Smiles: | CC1C=CC2=NC(CSc3ccccc3NC(c3ccco3)=O)=CC(N2C=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8378 |
| logD: | 2.8378 |
| logSw: | -3.3083 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.444 |
| InChI Key: | CKEONAVKZCKHMJ-UHFFFAOYSA-N |