3,4-dimethoxy-N-(2-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
3,4-dimethoxy-N-(2-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
3,4-dimethoxy-N-(2-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | F880-0581 |
| Compound Name: | 3,4-dimethoxy-N-(2-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 461.54 |
| Molecular Formula: | C25 H23 N3 O4 S |
| Smiles: | CC1C=CN2C(C=1)=NC(CSc1ccccc1NC(c1ccc(c(c1)OC)OC)=O)=CC2=O |
| Stereo: | ACHIRAL |
| logP: | 3.1356 |
| logD: | 3.1355 |
| logSw: | -3.4982 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.608 |
| InChI Key: | YMJIYYNCEZQPFE-UHFFFAOYSA-N |