2-(azepane-1-carbonyl)-3-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-3-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one
2-(azepane-1-carbonyl)-3-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | E213-0638 |
| Compound Name: | 2-(azepane-1-carbonyl)-3-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 345.46 |
| Molecular Formula: | C18 H23 N3 O2 S |
| Smiles: | Cc1c2C(N3CCCCC3=Nc2sc1C(N1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5494 |
| logD: | 2.5494 |
| logSw: | -2.2396 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.27 |
| InChI Key: | KMMNWVDTOBSQIK-UHFFFAOYSA-N |