ethyl 3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxylate
ethyl 3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | Y021-3168 |
| Compound Name: | ethyl 3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 232.24 |
| Molecular Formula: | C12 H12 N2 O3 |
| Smiles: | CCOC(C1=CNN(C1=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2174 |
| logD: | -0.4093 |
| logSw: | -1.9967 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.137 |
| InChI Key: | RWFAFMVYYSHQLZ-UHFFFAOYSA-N |