[2-({[4-(3-chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl][4-(2-fluorophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[2-({[4-(3-chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl][4-(2-fluorophenyl)piperazin-1-yl]methanone
[2-({[4-(3-chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl][4-(2-fluorophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | V003-3206 |
| Compound Name: | [2-({[4-(3-chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl][4-(2-fluorophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 574.08 |
| Molecular Formula: | C30 H25 Cl F N5 O2 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1C(c1ccccc1CSc1nnc(c2ccco2)n1c1cccc(c1)[Cl])=O)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 6.0315 |
| logD: | 6.0315 |
| logSw: | -6.1692 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.899 |
| InChI Key: | ZYRWOLCWWQGMJP-UHFFFAOYSA-N |