N'-({3-[(2,4-dichlorophenoxy)methyl]-4-methoxyphenyl}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-[(2,4-dichlorophenoxy)methyl]-4-methoxyphenyl}methylidene)-2-({4-ethyl-5-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
N'-({3-[(2,4-dichlorophenoxy)methyl]-4-methoxyphenyl}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: | Y501-9430 |
| Compound Name: | N'-({3-[(2,4-dichlorophenoxy)methyl]-4-methoxyphenyl}methylidene)-2-({4-ethyl-5-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide |
| Molecular Weight: | 642.49 |
| Molecular Formula: | C26 H24 Cl2 F3 N7 O3 S |
| Smiles: | CCn1c(c2cc(C(F)(F)F)nn2C)nnc1SCC(N/N=C/c1ccc(c(COc2ccc(cc2[Cl])[Cl])c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2721 |
| logD: | 5.272 |
| logSw: | -5.9971 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.8 |
| InChI Key: | ANPRHMNVAXHTMR-UHFFFAOYSA-N |