2-(azepane-1-carbonyl)-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one
2-(azepane-1-carbonyl)-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C243-0040 |
| Compound Name: | 2-(azepane-1-carbonyl)-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 327.4 |
| Molecular Formula: | C17 H17 N3 O2 S |
| Smiles: | C1CCCN(CC1)C(c1cc2C(N3C=CC=CC3=Nc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8338 |
| logD: | 2.8338 |
| logSw: | -3.2304 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.366 |
| InChI Key: | YTCHJVNVQAWDJS-UHFFFAOYSA-N |