2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3-phenoxyphenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3-phenoxyphenyl)methylidene]acetohydrazide
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3-phenoxyphenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | 3254-1615 |
| Compound Name: | 2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3-phenoxyphenyl)methylidene]acetohydrazide |
| Molecular Weight: | 561.71 |
| Molecular Formula: | C33 H31 N5 O2 S |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nnc(n1c1ccccc1)SCC(N/N=C/c1cccc(c1)Oc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 8.0302 |
| logD: | 8.0301 |
| logSw: | -5.7093 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.834 |
| InChI Key: | GWDJLYWCJAEMKB-UHFFFAOYSA-N |