1-(3,5-dimethylphenyl)-5-methyl-4-[4-(propan-2-yl)benzene-1-sulfonyl]-1H-1,2,3-triazole
Chemical Structure Depiction of
1-(3,5-dimethylphenyl)-5-methyl-4-[4-(propan-2-yl)benzene-1-sulfonyl]-1H-1,2,3-triazole
1-(3,5-dimethylphenyl)-5-methyl-4-[4-(propan-2-yl)benzene-1-sulfonyl]-1H-1,2,3-triazole
Compound characteristics
| Compound ID: | C595-0609 |
| Compound Name: | 1-(3,5-dimethylphenyl)-5-methyl-4-[4-(propan-2-yl)benzene-1-sulfonyl]-1H-1,2,3-triazole |
| Molecular Weight: | 369.48 |
| Molecular Formula: | C20 H23 N3 O2 S |
| Smiles: | CC(C)c1ccc(cc1)S(c1c(C)n(c2cc(C)cc(C)c2)nn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2066 |
| logD: | 5.2066 |
| logSw: | -5.1741 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.357 |
| InChI Key: | AAFUIAVNQOTHTE-UHFFFAOYSA-N |