4-(2-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-(4-bromophenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-(2-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-(4-bromophenyl)piperazine-1-carboxamide
4-(2-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-(4-bromophenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V012-1771 |
| Compound Name: | 4-(2-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-(4-bromophenyl)piperazine-1-carboxamide |
| Molecular Weight: | 562.53 |
| Molecular Formula: | C28 H28 Br N5 O S |
| Salt: | not_available |
| Smiles: | C1CCc2c(C1)c1c(nc(Cc3ccccc3)nc1s2)N1CCN(CC1)C(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 7.2543 |
| logD: | 7.1322 |
| logSw: | -6.1892 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.216 |
| InChI Key: | CEPDLNXBEDCOLY-UHFFFAOYSA-N |