methyl 3-acetyl-1-phenyl-4,5-dihydro-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
methyl 3-acetyl-1-phenyl-4,5-dihydro-1H-pyrazole-4-carboxylate
methyl 3-acetyl-1-phenyl-4,5-dihydro-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | 8008-1489 |
| Compound Name: | methyl 3-acetyl-1-phenyl-4,5-dihydro-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 246.26 |
| Molecular Formula: | C13 H14 N2 O3 |
| Smiles: | CC(C1C(CN(c2ccccc2)N=1)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6028 |
| logD: | 1.6026 |
| logSw: | -1.7432 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.605 |
| InChI Key: | MXTRLRLVEPGNQC-LLVKDONJSA-N |