4-({[4-(2-fluorophenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(3-methylphenyl)benzamide
Chemical Structure Depiction of
4-({[4-(2-fluorophenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(3-methylphenyl)benzamide
4-({[4-(2-fluorophenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(3-methylphenyl)benzamide
Compound characteristics
| Compound ID: | V029-9944 |
| Compound Name: | 4-({[4-(2-fluorophenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(3-methylphenyl)benzamide |
| Molecular Weight: | 500.62 |
| Molecular Formula: | C27 H21 F N4 O S2 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)NC(c1ccc(CSc2nnc(c3cccs3)n2c2ccccc2F)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.977 |
| logD: | 5.9769 |
| logSw: | -5.5085 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.521 |
| InChI Key: | RHADLJOXZPFZHU-UHFFFAOYSA-N |