N-{[4-(2,6-diethylphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-3,4,5-triethoxybenzamide
Chemical Structure Depiction of
N-{[4-(2,6-diethylphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-3,4,5-triethoxybenzamide
N-{[4-(2,6-diethylphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-3,4,5-triethoxybenzamide
Compound characteristics
| Compound ID: | 3330-2845 |
| Compound Name: | N-{[4-(2,6-diethylphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-3,4,5-triethoxybenzamide |
| Molecular Weight: | 498.64 |
| Molecular Formula: | C26 H34 N4 O4 S |
| Smiles: | CCc1cccc(CC)c1N1C(CNC(c2cc(c(c(c2)OCC)OCC)OCC)=O)=NNC1=S |
| Stereo: | ACHIRAL |
| logP: | 5.256 |
| logD: | 4.6953 |
| logSw: | -5.0894 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.63 |
| InChI Key: | WZYJHWMSKMJWRX-UHFFFAOYSA-N |