4-benzylidene-5-ethoxy-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-benzylidene-5-ethoxy-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
4-benzylidene-5-ethoxy-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 2339-2227 |
| Compound Name: | 4-benzylidene-5-ethoxy-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 337.33 |
| Molecular Formula: | C18 H15 N3 O4 |
| Smiles: | CCOC1/C(=C/c2ccccc2)C(N(c2ccc(cc2)[N+]([O-])=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.666 |
| logD: | 3.666 |
| logSw: | -3.7919 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.947 |
| InChI Key: | DTDQQLAHAUAAHO-UHFFFAOYSA-N |