4-(3-methylphenyl)-3-(thiophen-2-yl)-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
4-(3-methylphenyl)-3-(thiophen-2-yl)-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
4-(3-methylphenyl)-3-(thiophen-2-yl)-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V012-0631 |
| Compound Name: | 4-(3-methylphenyl)-3-(thiophen-2-yl)-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole |
| Molecular Weight: | 431.5 |
| Molecular Formula: | C21 H16 F3 N3 S2 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)n1c(c2cccs2)nnc1SCc1ccc(cc1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.1729 |
| logD: | 6.1726 |
| logSw: | -5.7897 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.7309 |
| InChI Key: | SFARSMJXCFMIQY-UHFFFAOYSA-N |