9-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
9-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxamide
9-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | G905-0955 |
| Compound Name: | 9-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 339.41 |
| Molecular Formula: | C18 H17 N3 O2 S |
| Smiles: | CC1=CC=CN2C1=NC=C(C(NCc1ccc(cc1)SC)=O)C2=O |
| Stereo: | ACHIRAL |
| logP: | 2.2043 |
| logD: | 1.9022 |
| logSw: | -2.602 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.908 |
| InChI Key: | NELUKURZCYEYKH-UHFFFAOYSA-N |