2-[(3-benzyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(5-chloro-2-methylphenyl)acetamide
Chemical Structure Depiction of
2-[(3-benzyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(5-chloro-2-methylphenyl)acetamide
2-[(3-benzyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(5-chloro-2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | 8017-8971 |
| Compound Name: | 2-[(3-benzyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(5-chloro-2-methylphenyl)acetamide |
| Molecular Weight: | 510.08 |
| Molecular Formula: | C26 H24 Cl N3 O2 S2 |
| Smiles: | Cc1ccc(cc1NC(CSC1=Nc2c(C(N1Cc1ccccc1)=O)c1CCCCc1s2)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.953 |
| logD: | 5.9528 |
| logSw: | -6.0237 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.046 |
| InChI Key: | LRDMJTFGDUMEQF-UHFFFAOYSA-N |