4-bromo-2-{[2-(5,5-diphenyl-4,5-dihydro-1H-pyrazole-3-carbonyl)hydrazinylidene]methyl}phenyl 4-bromobenzoate
Chemical Structure Depiction of
4-bromo-2-{[2-(5,5-diphenyl-4,5-dihydro-1H-pyrazole-3-carbonyl)hydrazinylidene]methyl}phenyl 4-bromobenzoate
4-bromo-2-{[2-(5,5-diphenyl-4,5-dihydro-1H-pyrazole-3-carbonyl)hydrazinylidene]methyl}phenyl 4-bromobenzoate
Compound characteristics
| Compound ID: | 8005-6771 |
| Compound Name: | 4-bromo-2-{[2-(5,5-diphenyl-4,5-dihydro-1H-pyrazole-3-carbonyl)hydrazinylidene]methyl}phenyl 4-bromobenzoate |
| Molecular Weight: | 646.34 |
| Molecular Formula: | C30 H22 Br2 N4 O3 |
| Smiles: | C1C(C(N/N=C/c2cc(ccc2OC(c2ccc(cc2)[Br])=O)[Br])=O)=NNC1(c1ccccc1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.6336 |
| logD: | 7.5223 |
| logSw: | -6.2673 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.631 |
| InChI Key: | WJOYEHKKVPQHLT-UHFFFAOYSA-N |