{[4-(2,3-dimethylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
Chemical Structure Depiction of
{[4-(2,3-dimethylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
{[4-(2,3-dimethylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
Compound characteristics
| Compound ID: | C663-0681 |
| Compound Name: | {[4-(2,3-dimethylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid |
| Molecular Weight: | 345.44 |
| Molecular Formula: | C16 H15 N3 O2 S2 |
| Smiles: | Cc1cccc(c1C)n1c(c2cccs2)nnc1SCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4664 |
| logD: | 0.1739 |
| logSw: | -3.5775 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.085 |
| InChI Key: | LHZKMFZRJIUFTR-UHFFFAOYSA-N |