N'-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-2-{[5-{[(naphthalen-1-yl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Chemical Structure Depiction of
N'-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-2-{[5-{[(naphthalen-1-yl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
N'-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-2-{[5-{[(naphthalen-1-yl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Compound characteristics
| Compound ID: | Y508-3480 |
| Compound Name: | N'-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-2-{[5-{[(naphthalen-1-yl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide |
| Molecular Weight: | 595.52 |
| Molecular Formula: | C27 H27 Br N6 O3 S |
| Smiles: | COc1cc(c(cc1/C=N/NC(CSc1nnc(CNc2cccc3ccccc23)n1CC=C)=O)[Br])OC |
| Stereo: | ACHIRAL |
| logP: | 5.2119 |
| logD: | 5.2115 |
| logSw: | -6.0554 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.367 |
| InChI Key: | DDYOTNIEZUGYHC-UHFFFAOYSA-N |