ethyl (5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetate
Chemical Structure Depiction of
ethyl (5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetate
ethyl (5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetate
Compound characteristics
| Compound ID: | R052-0392 |
| Compound Name: | ethyl (5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetate |
| Molecular Weight: | 246.26 |
| Molecular Formula: | C13 H14 N2 O3 |
| Smiles: | CCOC(CC1CC(N(c2ccccc2)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3036 |
| logD: | 0.2137 |
| logSw: | -1.8246 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.828 |
| InChI Key: | YSNRXCNLMQFZGG-UHFFFAOYSA-N |