5-methyl-4-[4-(propan-2-yl)benzene-1-sulfonyl]-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole
Chemical Structure Depiction of
5-methyl-4-[4-(propan-2-yl)benzene-1-sulfonyl]-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole
5-methyl-4-[4-(propan-2-yl)benzene-1-sulfonyl]-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole
Compound characteristics
| Compound ID: | C595-0619 |
| Compound Name: | 5-methyl-4-[4-(propan-2-yl)benzene-1-sulfonyl]-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole |
| Molecular Weight: | 409.43 |
| Molecular Formula: | C19 H18 F3 N3 O2 S |
| Smiles: | CC(C)c1ccc(cc1)S(c1c(C)n(c2cccc(c2)C(F)(F)F)nn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0698 |
| logD: | 5.0698 |
| logSw: | -4.8326 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.357 |
| InChI Key: | ACCNEHMNDJZYDL-UHFFFAOYSA-N |