N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-2-(3-methylphenoxy)propanamide
Chemical Structure Depiction of
N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-2-(3-methylphenoxy)propanamide
N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-2-(3-methylphenoxy)propanamide
Compound characteristics
| Compound ID: | F880-0659 |
| Compound Name: | N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-2-(3-methylphenoxy)propanamide |
| Molecular Weight: | 459.57 |
| Molecular Formula: | C26 H25 N3 O3 S |
| Smiles: | CC(C(Nc1ccccc1SCC1=CC(N2C=CC=C(C)C2=N1)=O)=O)Oc1cccc(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3215 |
| logD: | 4.3215 |
| logSw: | -4.2671 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.157 |
| InChI Key: | UGSNBLYCWQGOOG-IBGZPJMESA-N |