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
N-{2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]ethyl}benzamide
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: | 1309-0087 |
| Compound Name: | 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: | 453.75 |
| Molecular Formula: | C20 H19 Cl3 N4 O2 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(C([Cl])([Cl])[Cl])NC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6795 |
| logD: | 1.5146 |
| logSw: | -3.5922 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.831 |
| InChI Key: | HNKCRSOXDGVYPZ-LJQANCHMSA-N |