2-{[5-(anilinomethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-methylphenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[5-(anilinomethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-methylphenyl)methylidene]acetohydrazide
2-{[5-(anilinomethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-methylphenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | Y508-3162 |
| Compound Name: | 2-{[5-(anilinomethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-methylphenyl)methylidene]acetohydrazide |
| Molecular Weight: | 420.54 |
| Molecular Formula: | C22 H24 N6 O S |
| Smiles: | Cc1ccc(/C=N/NC(CSc2nnc(CNc3ccccc3)n2CC=C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5156 |
| logD: | 3.5154 |
| logSw: | -3.6135 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.075 |
| InChI Key: | XEPVVBSBDFDFSA-UHFFFAOYSA-N |