2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[1-(4-hydroxy-3-methoxyphenyl)ethylidene]acetohydrazide
Chemical Structure Depiction of
2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[1-(4-hydroxy-3-methoxyphenyl)ethylidene]acetohydrazide
2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[1-(4-hydroxy-3-methoxyphenyl)ethylidene]acetohydrazide
Compound characteristics
| Compound ID: | 3254-2100 |
| Compound Name: | 2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[1-(4-hydroxy-3-methoxyphenyl)ethylidene]acetohydrazide |
| Molecular Weight: | 455.53 |
| Molecular Formula: | C22 H25 N5 O4 S |
| Smiles: | CCn1c(c2ccc(cc2)OC)nnc1SCC(N/N=C(\C)c1ccc(c(c1)OC)O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.203 |
| logD: | 3.2019 |
| logSw: | -3.1409 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.35 |
| InChI Key: | ITBYWMRPOXYWEA-UHFFFAOYSA-N |