N'-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-({4-ethyl-5-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
Chemical Structure Depiction of
N'-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-({4-ethyl-5-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
N'-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-({4-ethyl-5-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
Compound characteristics
| Compound ID: | Y501-9431 |
| Compound Name: | N'-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-({4-ethyl-5-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide |
| Molecular Weight: | 497.5 |
| Molecular Formula: | C20 H22 F3 N7 O3 S |
| Smiles: | CCn1c(c2cc(C(F)(F)F)nn2C)nnc1SCC(N/N=C/c1ccc(c(c1)OCC)O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6454 |
| logD: | 2.6439 |
| logSw: | -2.7116 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.614 |
| InChI Key: | PQFQRZQNLQNMRN-UHFFFAOYSA-N |