2,2-dimethyl-1-{4-[2-(2-phenylethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one
Chemical Structure Depiction of
2,2-dimethyl-1-{4-[2-(2-phenylethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one
2,2-dimethyl-1-{4-[2-(2-phenylethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one
Compound characteristics
| Compound ID: | V001-3104 |
| Compound Name: | 2,2-dimethyl-1-{4-[2-(2-phenylethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one |
| Molecular Weight: | 462.66 |
| Molecular Formula: | C27 H34 N4 O S |
| Salt: | not_available |
| Smiles: | CC(C)(C)C(N1CCN(CC1)c1c2c3CCCCc3sc2nc(CCc2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6291 |
| logD: | 6.2385 |
| logSw: | -5.8989 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.667 |
| InChI Key: | AHKVCGLRLBSHPQ-UHFFFAOYSA-N |