{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}[4-(trifluoromethyl)phenyl]methanone
Chemical Structure Depiction of
{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}[4-(trifluoromethyl)phenyl]methanone
{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}[4-(trifluoromethyl)phenyl]methanone
Compound characteristics
| Compound ID: | V013-5526 |
| Compound Name: | {4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}[4-(trifluoromethyl)phenyl]methanone |
| Molecular Weight: | 502.6 |
| Molecular Formula: | C26 H29 F3 N4 O S |
| Smiles: | CC1CCc2c3c(nc(C(C)C)nc3sc2C1)N1CCN(CC1)C(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7289 |
| logD: | 6.4603 |
| logSw: | -5.9565 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.676 |
| InChI Key: | CEVDVFURBNXNDR-INIZCTEOSA-N |