2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)acetamide
Chemical Structure Depiction of
2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)acetamide
2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)acetamide
Compound characteristics
| Compound ID: | F880-0513 |
| Compound Name: | 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(2-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)acetamide |
| Molecular Weight: | 484.53 |
| Molecular Formula: | C26 H20 N4 O4 S |
| Smiles: | CC1C=CC2=NC(CSc3ccccc3NC(CN3C(c4ccccc4C3=O)=O)=O)=CC(N2C=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6328 |
| logD: | 2.6327 |
| logSw: | -3.3207 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.177 |
| InChI Key: | WDUYDABUKBMUAX-UHFFFAOYSA-N |