2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide
Chemical Structure Depiction of
2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide
2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide
Compound characteristics
| Compound ID: | 3254-1997 |
| Compound Name: | 2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide |
| Molecular Weight: | 463.48 |
| Molecular Formula: | C21 H20 F3 N5 O2 S |
| Smiles: | CCn1c(c2ccc(cc2)OC)nnc1SCC(N/N=C/c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5086 |
| logD: | 4.5083 |
| logSw: | -4.224 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.883 |
| InChI Key: | HMCLZWIALRSTJA-UHFFFAOYSA-N |