N-(3,4-dimethylphenyl)-4-({[4-(4-fluorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-4-({[4-(4-fluorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
N-(3,4-dimethylphenyl)-4-({[4-(4-fluorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Compound characteristics
| Compound ID: | V025-3781 |
| Compound Name: | N-(3,4-dimethylphenyl)-4-({[4-(4-fluorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide |
| Molecular Weight: | 498.58 |
| Molecular Formula: | C28 H23 F N4 O2 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1C)NC(c1ccc(CSc2nnc(c3ccco3)n2c2ccc(cc2)F)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9091 |
| logD: | 5.909 |
| logSw: | -5.4538 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.382 |
| InChI Key: | UXWFXDXGIZXHSX-UHFFFAOYSA-N |