N-(4-cyanophenyl)-4-(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-(4-cyanophenyl)-4-(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide
N-(4-cyanophenyl)-4-(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V021-8240 |
| Compound Name: | N-(4-cyanophenyl)-4-(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide |
| Molecular Weight: | 446.57 |
| Molecular Formula: | C24 H26 N6 O S |
| Salt: | not_available |
| Smiles: | CCc1nc(c2c3CCCCc3sc2n1)N1CCN(CC1)C(Nc1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9853 |
| logD: | 4.5557 |
| logSw: | -4.782 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.544 |
| InChI Key: | BKCKBLLERMDMEC-UHFFFAOYSA-N |