1-(2,5-dimethoxyphenyl)-5-methyl-4-(4-methylbenzene-1-sulfonyl)-1H-1,2,3-triazole
Chemical Structure Depiction of
1-(2,5-dimethoxyphenyl)-5-methyl-4-(4-methylbenzene-1-sulfonyl)-1H-1,2,3-triazole
1-(2,5-dimethoxyphenyl)-5-methyl-4-(4-methylbenzene-1-sulfonyl)-1H-1,2,3-triazole
Compound characteristics
Compound ID: | C595-0382 |
Compound Name: | 1-(2,5-dimethoxyphenyl)-5-methyl-4-(4-methylbenzene-1-sulfonyl)-1H-1,2,3-triazole |
Molecular Weight: | 373.43 |
Molecular Formula: | C18 H19 N3 O4 S |
Smiles: | Cc1ccc(cc1)S(c1c(C)n(c2cc(ccc2OC)OC)nn1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4193 |
logD: | 3.4193 |
logSw: | -3.8853 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 71.23 |
InChI Key: | DXYRRGYZBRAKFU-UHFFFAOYSA-N |