N-(2-benzoyl-4-chlorophenyl)-3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)prop-2-enamide
Chemical Structure Depiction of
N-(2-benzoyl-4-chlorophenyl)-3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)prop-2-enamide
N-(2-benzoyl-4-chlorophenyl)-3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)prop-2-enamide
Compound characteristics
| Compound ID: | Y508-7035 |
| Compound Name: | N-(2-benzoyl-4-chlorophenyl)-3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)prop-2-enamide |
| Molecular Weight: | 455.94 |
| Molecular Formula: | C27 H22 Cl N3 O2 |
| Smiles: | Cc1c(/C=C/C(Nc2ccc(cc2C(c2ccccc2)=O)[Cl])=O)c(C)n(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.5316 |
| logD: | 5.5313 |
| logSw: | -5.8664 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.303 |
| InChI Key: | XBEDSJFQBIPXHB-UHFFFAOYSA-N |