5-methyl-N-[3-(methylsulfanyl)phenyl]-1-phenyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-methyl-N-[3-(methylsulfanyl)phenyl]-1-phenyl-1H-1,2,3-triazole-4-carboxamide
5-methyl-N-[3-(methylsulfanyl)phenyl]-1-phenyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C200-2545 |
| Compound Name: | 5-methyl-N-[3-(methylsulfanyl)phenyl]-1-phenyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 324.4 |
| Molecular Formula: | C17 H16 N4 O S |
| Smiles: | Cc1c(C(Nc2cccc(c2)SC)=O)nnn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2099 |
| logD: | 3.2098 |
| logSw: | -3.5351 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.173 |
| InChI Key: | RCGZIKMOBYHHNB-UHFFFAOYSA-N |