2-(4-fluorophenyl)-1-{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-fluorophenyl)-1-{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
2-(4-fluorophenyl)-1-{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V001-3957 |
| Compound Name: | 2-(4-fluorophenyl)-1-{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 466.62 |
| Molecular Formula: | C26 H31 F N4 O S |
| Smiles: | CC1CCc2c3c(nc(C(C)C)nc3sc2C1)N1CCN(CC1)C(Cc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1645 |
| logD: | 5.8122 |
| logSw: | -5.7991 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.149 |
| InChI Key: | HKKZPAYODRJCQL-KRWDZBQOSA-N |