diethyl {[(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)amino]methylidene}propanedioate
Chemical Structure Depiction of
diethyl {[(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)amino]methylidene}propanedioate
diethyl {[(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)amino]methylidene}propanedioate
Compound characteristics
| Compound ID: | 4401-0044 |
| Compound Name: | diethyl {[(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)amino]methylidene}propanedioate |
| Molecular Weight: | 331.37 |
| Molecular Formula: | C17 H21 N3 O4 |
| Smiles: | CCOC(C(=CNC1CCN(c2ccccc2)N=1)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5589 |
| logD: | 0.0687 |
| logSw: | -2.6022 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.764 |
| InChI Key: | JSNNIQGOINFBHA-UHFFFAOYSA-N |