1-[4-(4-fluorophenyl)piperazin-1-yl]-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-[4-(4-fluorophenyl)piperazin-1-yl]-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]ethan-1-one
1-[4-(4-fluorophenyl)piperazin-1-yl]-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | C201-1185 |
| Compound Name: | 1-[4-(4-fluorophenyl)piperazin-1-yl]-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 482.6 |
| Molecular Formula: | C23 H23 F N6 O S2 |
| Smiles: | C1CCc2c(C1)c1c3nnc(n3C=Nc1s2)SCC(N1CCN(CC1)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5139 |
| logD: | 3.5139 |
| logSw: | -3.9428 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.488 |
| InChI Key: | ZIRKYERVHAAEGC-UHFFFAOYSA-N |