5-methyl-4-(4-methylbenzene-1-sulfonyl)-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole
Chemical Structure Depiction of
5-methyl-4-(4-methylbenzene-1-sulfonyl)-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole
5-methyl-4-(4-methylbenzene-1-sulfonyl)-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole
Compound characteristics
| Compound ID: | C595-0384 |
| Compound Name: | 5-methyl-4-(4-methylbenzene-1-sulfonyl)-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole |
| Molecular Weight: | 381.37 |
| Molecular Formula: | C17 H14 F3 N3 O2 S |
| Smiles: | Cc1ccc(cc1)S(c1c(C)n(c2cccc(c2)C(F)(F)F)nn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1549 |
| logD: | 4.1549 |
| logSw: | -4.3138 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.357 |
| InChI Key: | XXZLTUBDWWPJQN-UHFFFAOYSA-N |