1-[4-(1-ethyl-1H-benzimidazol-2-yl)piperazin-1-yl]-2-{[(4-fluorophenyl)methyl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-[4-(1-ethyl-1H-benzimidazol-2-yl)piperazin-1-yl]-2-{[(4-fluorophenyl)methyl]sulfanyl}ethan-1-one
1-[4-(1-ethyl-1H-benzimidazol-2-yl)piperazin-1-yl]-2-{[(4-fluorophenyl)methyl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | L054-0125 |
| Compound Name: | 1-[4-(1-ethyl-1H-benzimidazol-2-yl)piperazin-1-yl]-2-{[(4-fluorophenyl)methyl]sulfanyl}ethan-1-one |
| Molecular Weight: | 412.53 |
| Molecular Formula: | C22 H25 F N4 O S |
| Smiles: | [H]c1cc2c(cc1[H])n(CC)c(n2)N1CCN(CC1)C(CSCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.247 |
| logD: | 4.2048 |
| logSw: | -4.0687 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.0853 |
| InChI Key: | GWJWRUJFBHRYCY-UHFFFAOYSA-N |