methyl (5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetate
Chemical Structure Depiction of
methyl (5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetate
methyl (5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetate
Compound characteristics
| Compound ID: | 8015-0069 |
| Compound Name: | methyl (5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetate |
| Molecular Weight: | 232.24 |
| Molecular Formula: | C12 H12 N2 O3 |
| Smiles: | COC(CC1CC(N(c2ccccc2)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.851 |
| logD: | -0.2389 |
| logSw: | -1.2689 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.248 |
| InChI Key: | RJIDGRHOHFDKKB-UHFFFAOYSA-N |