4-(2-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Chemical Structure Depiction of
4-(2-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carboxamide
4-(2-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V016-7043 |
| Compound Name: | 4-(2-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carboxamide |
| Molecular Weight: | 551.63 |
| Molecular Formula: | C29 H28 F3 N5 O S |
| Salt: | not_available |
| Smiles: | C1CCc2c(C1)c1c(nc(Cc3ccccc3)nc1s2)N1CCN(CC1)C(Nc1ccccc1C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.3321 |
| logD: | 7.21 |
| logSw: | -6.2795 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.519 |
| InChI Key: | BUXUTQDHBZEVTL-UHFFFAOYSA-N |