1-(4-methoxyphenyl)-N-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-(4-methoxyphenyl)-N-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
1-(4-methoxyphenyl)-N-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D296-0161 |
| Compound Name: | 1-(4-methoxyphenyl)-N-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 340.4 |
| Molecular Formula: | C17 H16 N4 O2 S |
| Smiles: | COc1ccc(cc1)n1cc(C(Nc2cccc(c2)SC)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 3.3143 |
| logD: | 3.3143 |
| logSw: | -3.7177 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.239 |
| InChI Key: | KLZGNOZUQKMFHP-UHFFFAOYSA-N |