3,4,5-trimethoxy-N-(2-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
3,4,5-trimethoxy-N-(2-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
3,4,5-trimethoxy-N-(2-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | F880-0583 |
| Compound Name: | 3,4,5-trimethoxy-N-(2-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 491.57 |
| Molecular Formula: | C26 H25 N3 O5 S |
| Smiles: | CC1C=CN2C(C=1)=NC(CSc1ccccc1NC(c1cc(c(c(c1)OC)OC)OC)=O)=CC2=O |
| Stereo: | ACHIRAL |
| logP: | 3.2921 |
| logD: | 3.2921 |
| logSw: | -3.6588 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.325 |
| InChI Key: | XAFDMACSMLFDMG-UHFFFAOYSA-N |