3-({[4-(2-fluorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
Chemical Structure Depiction of
3-({[4-(2-fluorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
3-({[4-(2-fluorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
Compound characteristics
| Compound ID: | V029-8220 |
| Compound Name: | 3-({[4-(2-fluorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide |
| Molecular Weight: | 490.6 |
| Molecular Formula: | C27 H27 F N4 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)CNC(c1cccc(CSc2nnc(c3cccc(c3)OC)n2c2ccccc2F)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5001 |
| logD: | 5.5001 |
| logSw: | -5.4069 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.64 |
| InChI Key: | QBOSNFRCZOFXGL-UHFFFAOYSA-N |