4-bromo-N-{2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]ethyl}benzamide
Chemical Structure Depiction of
4-bromo-N-{2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]ethyl}benzamide
4-bromo-N-{2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]ethyl}benzamide
Compound characteristics
| Compound ID: | 1501-0716 |
| Compound Name: | 4-bromo-N-{2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]ethyl}benzamide |
| Molecular Weight: | 532.65 |
| Molecular Formula: | C20 H18 Br Cl3 N4 O2 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(C([Cl])([Cl])[Cl])NC(c1ccc(cc1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6185 |
| logD: | 2.4535 |
| logSw: | -4.0929 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.831 |
| InChI Key: | RVSRNNWWDHEEHT-LJQANCHMSA-N |