propan-2-yl 4-{3-methyl-5-oxo-4-[(5-phenylfuran-2-yl)methylidene]-4,5-dihydro-1H-pyrazol-1-yl}benzoate
Chemical Structure Depiction of
propan-2-yl 4-{3-methyl-5-oxo-4-[(5-phenylfuran-2-yl)methylidene]-4,5-dihydro-1H-pyrazol-1-yl}benzoate
propan-2-yl 4-{3-methyl-5-oxo-4-[(5-phenylfuran-2-yl)methylidene]-4,5-dihydro-1H-pyrazol-1-yl}benzoate
Compound characteristics
| Compound ID: | 3972-0050 |
| Compound Name: | propan-2-yl 4-{3-methyl-5-oxo-4-[(5-phenylfuran-2-yl)methylidene]-4,5-dihydro-1H-pyrazol-1-yl}benzoate |
| Molecular Weight: | 414.46 |
| Molecular Formula: | C25 H22 N2 O4 |
| Smiles: | CC(C)OC(c1ccc(cc1)N1C(C(=C/c2ccc(c3ccccc3)o2)\C(C)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3671 |
| logD: | 5.3671 |
| logSw: | -5.5222 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.589 |
| InChI Key: | XFLFVJYURQABLE-UHFFFAOYSA-N |