3,4-dimethoxy-N-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
3,4-dimethoxy-N-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
3,4-dimethoxy-N-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | F880-0753 |
| Compound Name: | 3,4-dimethoxy-N-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C24 H21 N3 O4 S |
| Smiles: | COc1ccc(cc1OC)C(Nc1ccccc1SCC1=CC(N2C=CC=CC2=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8232 |
| logD: | 2.8232 |
| logSw: | -3.524 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.608 |
| InChI Key: | VLHGBRLYWOYBIF-UHFFFAOYSA-N |