2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,4-dihydroxyphenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,4-dihydroxyphenyl)methylidene]acetohydrazide
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,4-dihydroxyphenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | 3254-1621 |
| Compound Name: | 2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,4-dihydroxyphenyl)methylidene]acetohydrazide |
| Molecular Weight: | 501.61 |
| Molecular Formula: | C27 H27 N5 O3 S |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nnc(n1c1ccccc1)SCC(N/N=C/c1ccc(cc1O)O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8701 |
| logD: | 5.8676 |
| logSw: | -5.2922 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.252 |
| InChI Key: | DGGVBDXRMKESSO-UHFFFAOYSA-N |