methyl {1-(4-methoxyphenyl)-5-oxo-4-[1-(propylamino)ethylidene]-4,5-dihydro-1H-pyrazol-3-yl}acetate
Chemical Structure Depiction of
methyl {1-(4-methoxyphenyl)-5-oxo-4-[1-(propylamino)ethylidene]-4,5-dihydro-1H-pyrazol-3-yl}acetate
methyl {1-(4-methoxyphenyl)-5-oxo-4-[1-(propylamino)ethylidene]-4,5-dihydro-1H-pyrazol-3-yl}acetate
Compound characteristics
| Compound ID: | Y600-3771 |
| Compound Name: | methyl {1-(4-methoxyphenyl)-5-oxo-4-[1-(propylamino)ethylidene]-4,5-dihydro-1H-pyrazol-3-yl}acetate |
| Molecular Weight: | 345.4 |
| Molecular Formula: | C18 H23 N3 O4 |
| Smiles: | CCCNC(\C)=C1\C(CC(=O)OC)=NN(C1=O)c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 1.9966 |
| logD: | 1.9838 |
| logSw: | -2.483 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.096 |
| InChI Key: | REVQUWMVMAJZAB-UHFFFAOYSA-N |