2-{[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-ethoxyphenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-ethoxyphenyl)methylidene]acetohydrazide
2-{[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-ethoxyphenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | 2357-3330 |
| Compound Name: | 2-{[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-ethoxyphenyl)methylidene]acetohydrazide |
| Molecular Weight: | 514.44 |
| Molecular Formula: | C23 H24 Br N5 O2 S |
| Smiles: | CCOc1ccc(/C=N/NC(CSc2nnc(c3ccc(cc3)[Br])n2CC(C)=C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6466 |
| logD: | 5.6463 |
| logSw: | -5.3978 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.738 |
| InChI Key: | SEZWJQZCSWXNCC-UHFFFAOYSA-N |