2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{[4-(propan-2-yl)phenyl]methylidene}acetohydrazide
Chemical Structure Depiction of
2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{[4-(propan-2-yl)phenyl]methylidene}acetohydrazide
2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{[4-(propan-2-yl)phenyl]methylidene}acetohydrazide
Compound characteristics
| Compound ID: | 3253-7871 |
| Compound Name: | 2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{[4-(propan-2-yl)phenyl]methylidene}acetohydrazide |
| Molecular Weight: | 469.61 |
| Molecular Formula: | C27 H27 N5 O S |
| Smiles: | CC(C)c1ccc(/C=N/NC(CSc2nnc(c3ccccc3)n2c2ccc(C)cc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.2681 |
| logD: | 6.2679 |
| logSw: | -5.5982 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.086 |
| InChI Key: | YQDYDUQDTUUOKW-UHFFFAOYSA-N |