N-(4-bromophenyl)-2-[(7-ethyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-[(7-ethyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
N-(4-bromophenyl)-2-[(7-ethyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8003-4426 |
| Compound Name: | N-(4-bromophenyl)-2-[(7-ethyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 554.53 |
| Molecular Formula: | C26 H24 Br N3 O2 S2 |
| Smiles: | CCC1CCc2c3C(N(C(=Nc3sc2C1)SCC(Nc1ccc(cc1)[Br])=O)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7141 |
| logD: | 6.7141 |
| logSw: | -5.8191 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.132 |
| InChI Key: | NXPMDEXIDGSLKF-MRXNPFEDSA-N |