N'-(2-bromo-3-phenylprop-2-en-1-ylidene)-2-{[5-(3,4-dimethoxyphenyl)-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-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
N'-(2-bromo-3-phenylprop-2-en-1-ylidene)-2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Compound characteristics
Compound ID: | 2357-3629 |
Compound Name: | N'-(2-bromo-3-phenylprop-2-en-1-ylidene)-2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide |
Molecular Weight: | 578.49 |
Molecular Formula: | C27 H24 Br N5 O3 S |
Smiles: | COc1ccc(cc1OC)c1nnc(n1c1ccccc1)SCC(N/N=C/C(=C/c1ccccc1)[Br])=O |
Stereo: | ACHIRAL |
logP: | 5.5217 |
logD: | 5.5196 |
logSw: | -5.5255 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.347 |
InChI Key: | CCZQCSRHXGHOGT-UHFFFAOYSA-N |