[2-({[4-(4-fluorophenyl)-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-(4-fluorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl][4-(2-fluorophenyl)piperazin-1-yl]methanone
[2-({[4-(4-fluorophenyl)-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: | V029-7960 |
| Compound Name: | [2-({[4-(4-fluorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl][4-(2-fluorophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 557.62 |
| Molecular Formula: | C30 H25 F2 N5 O2 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1C(c1ccccc1CSc1nnc(c2ccco2)n1c1ccc(cc1)F)=O)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 5.4518 |
| logD: | 5.4518 |
| logSw: | -5.7693 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.899 |
| InChI Key: | JPEAIBWFVJBSBQ-UHFFFAOYSA-N |