N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-2-(3-methylphenoxy)acetamide
Chemical Structure Depiction of
N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-2-(3-methylphenoxy)acetamide
N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-2-(3-methylphenoxy)acetamide
Compound characteristics
| Compound ID: | F880-0633 |
| Compound Name: | N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-2-(3-methylphenoxy)acetamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C25 H23 N3 O3 S |
| Smiles: | CC1=CC=CN2C1=NC(CSc1ccccc1NC(COc1cccc(C)c1)=O)=CC2=O |
| Stereo: | ACHIRAL |
| logP: | 3.8905 |
| logD: | 3.8905 |
| logSw: | -3.9674 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.653 |
| InChI Key: | BJGPGSDVWOPXFZ-UHFFFAOYSA-N |