propan-2-yl 4-{4-[(3-methoxy-4-propoxyphenyl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoate
Chemical Structure Depiction of
propan-2-yl 4-{4-[(3-methoxy-4-propoxyphenyl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoate
propan-2-yl 4-{4-[(3-methoxy-4-propoxyphenyl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoate
Compound characteristics
| Compound ID: | 3871-0334 |
| Compound Name: | propan-2-yl 4-{4-[(3-methoxy-4-propoxyphenyl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoate |
| Molecular Weight: | 436.51 |
| Molecular Formula: | C25 H28 N2 O5 |
| Smiles: | CCCOc1ccc(/C=C2/C(C)=NN(C2=O)c2ccc(cc2)C(=O)OC(C)C)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.9036 |
| logD: | 4.9036 |
| logSw: | -4.7001 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.154 |
| InChI Key: | QDWDFJBXKYGMSE-UHFFFAOYSA-N |