2-[(7-ethyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-ethylphenyl)acetamide
Chemical Structure Depiction of
2-[(7-ethyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-ethylphenyl)acetamide
2-[(7-ethyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | 8009-2168 |
| Compound Name: | 2-[(7-ethyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-ethylphenyl)acetamide |
| Molecular Weight: | 503.69 |
| Molecular Formula: | C28 H29 N3 O2 S2 |
| Smiles: | CCC1CCc2c3C(N(C(=Nc3sc2C1)SCC(Nc1ccc(CC)cc1)=O)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8109 |
| logD: | 6.8109 |
| logSw: | -5.814 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.132 |
| InChI Key: | XSJHLWSLOKLPRY-LJQANCHMSA-N |