N'-(2-bromo-3-phenylprop-2-en-1-ylidene)-2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Chemical Structure Depiction of
N'-(2-bromo-3-phenylprop-2-en-1-ylidene)-2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
N'-(2-bromo-3-phenylprop-2-en-1-ylidene)-2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Compound characteristics
| Compound ID: | 3254-1647 |
| Compound Name: | N'-(2-bromo-3-phenylprop-2-en-1-ylidene)-2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide |
| Molecular Weight: | 574.54 |
| Molecular Formula: | C29 H28 Br N5 O S |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nnc(n1c1ccccc1)SCC(N/N=C/C(=C/c1ccccc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 7.6937 |
| logD: | 7.6917 |
| logSw: | -5.8166 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.086 |
| InChI Key: | FXRQJRILIPDTBJ-UHFFFAOYSA-N |