{[4-ethyl-5-(2-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
Chemical Structure Depiction of
{[4-ethyl-5-(2-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
{[4-ethyl-5-(2-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
Compound characteristics
| Compound ID: | 7445-0120 |
| Compound Name: | {[4-ethyl-5-(2-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid |
| Molecular Weight: | 279.31 |
| Molecular Formula: | C12 H13 N3 O3 S |
| Smiles: | CCn1c(c2ccccc2O)nnc1SCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9358 |
| logD: | -1.3567 |
| logSw: | -2.4418 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.169 |
| InChI Key: | CCRAINLNUZABID-UHFFFAOYSA-N |