4-(2-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-(3-chloro-4-methylphenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-(2-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-(3-chloro-4-methylphenyl)piperazine-1-carboxamide
4-(2-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-(3-chloro-4-methylphenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V012-8793 |
| Compound Name: | 4-(2-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-(3-chloro-4-methylphenyl)piperazine-1-carboxamide |
| Molecular Weight: | 532.11 |
| Molecular Formula: | C29 H30 Cl N5 O S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1[Cl])NC(N1CCN(CC1)c1c2c3CCCCc3sc2nc(Cc2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.8106 |
| logD: | 7.6885 |
| logSw: | -6.4277 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.216 |
| InChI Key: | QFEKURNZGYFYOH-UHFFFAOYSA-N |