2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3,5-di-tert-butyl-4-hydroxyphenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3,5-di-tert-butyl-4-hydroxyphenyl)methylidene]acetohydrazide
2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3,5-di-tert-butyl-4-hydroxyphenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | 3254-1476 |
| Compound Name: | 2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3,5-di-tert-butyl-4-hydroxyphenyl)methylidene]acetohydrazide |
| Molecular Weight: | 590.19 |
| Molecular Formula: | C32 H36 Cl N5 O2 S |
| Smiles: | Cc1ccc(cc1)n1c(c2ccc(cc2)[Cl])nnc1SCC(N/N=C/c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 8.321 |
| logD: | 8.3209 |
| logSw: | -6.0956 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.566 |
| InChI Key: | KJPKWZFZECMEBA-UHFFFAOYSA-N |