ethyl 2-cyano-3-{1-[(2,6-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}prop-2-enoate
Chemical Structure Depiction of
ethyl 2-cyano-3-{1-[(2,6-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}prop-2-enoate
ethyl 2-cyano-3-{1-[(2,6-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}prop-2-enoate
Compound characteristics
| Compound ID: | 8009-4123 |
| Compound Name: | ethyl 2-cyano-3-{1-[(2,6-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}prop-2-enoate |
| Molecular Weight: | 426.3 |
| Molecular Formula: | C22 H17 Cl2 N3 O2 |
| Smiles: | CCOC(C(=C/c1cn(Cc2c(cccc2[Cl])[Cl])nc1c1ccccc1)\C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1924 |
| logD: | 5.1924 |
| logSw: | -5.6348 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.829 |
| InChI Key: | KNBOUWPUJBELSM-UHFFFAOYSA-N |