3-methyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
Chemical Structure Depiction of
3-methyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
3-methyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | E213-0881 |
| Compound Name: | 3-methyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide |
| Molecular Weight: | 413.56 |
| Molecular Formula: | C21 H23 N3 O2 S2 |
| Smiles: | Cc1c2C(N3CCCCC3=Nc2sc1C(NCCc1ccc(cc1)SC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1195 |
| logD: | 3.1195 |
| logSw: | -3.4079 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.546 |
| InChI Key: | JOAOCFAUFGBLRT-UHFFFAOYSA-N |