4-({[4-(2-fluorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(4-fluorophenyl)methyl]benzamide
Chemical Structure Depiction of
4-({[4-(2-fluorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(4-fluorophenyl)methyl]benzamide
4-({[4-(2-fluorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(4-fluorophenyl)methyl]benzamide
Compound characteristics
| Compound ID: | V005-0659 |
| Compound Name: | 4-({[4-(2-fluorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(4-fluorophenyl)methyl]benzamide |
| Molecular Weight: | 502.54 |
| Molecular Formula: | C27 H20 F2 N4 O2 S |
| Salt: | not_available |
| Smiles: | C(c1ccc(cc1)F)NC(c1ccc(CSc2nnc(c3ccco3)n2c2ccccc2F)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5411 |
| logD: | 4.541 |
| logSw: | -4.4756 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.403 |
| InChI Key: | JMIMWSZDCBJWIL-UHFFFAOYSA-N |