4-({[4-(1-methoxypropan-2-yl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}benzamide
Chemical Structure Depiction of
4-({[4-(1-methoxypropan-2-yl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}benzamide
4-({[4-(1-methoxypropan-2-yl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}benzamide
Compound characteristics
| Compound ID: | V029-7416 |
| Compound Name: | 4-({[4-(1-methoxypropan-2-yl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}benzamide |
| Molecular Weight: | 478.54 |
| Molecular Formula: | C23 H25 F3 N4 O2 S |
| Salt: | not_available |
| Smiles: | CC(COC)n1c(C)nnc1SCc1ccc(cc1)C(NCc1cccc(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1816 |
| logD: | 3.1816 |
| logSw: | -3.4384 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.786 |
| InChI Key: | GSQUEKQXXDSQGG-HNNXBMFYSA-N |