5-(4-methoxyphenyl)-2-(4-nitrophenyl)-4-{N-[2-(piperazin-1-yl)ethyl]ethanimidoyl}-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
5-(4-methoxyphenyl)-2-(4-nitrophenyl)-4-{N-[2-(piperazin-1-yl)ethyl]ethanimidoyl}-1,2-dihydro-3H-pyrazol-3-one
5-(4-methoxyphenyl)-2-(4-nitrophenyl)-4-{N-[2-(piperazin-1-yl)ethyl]ethanimidoyl}-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 4038-0285 |
| Compound Name: | 5-(4-methoxyphenyl)-2-(4-nitrophenyl)-4-{N-[2-(piperazin-1-yl)ethyl]ethanimidoyl}-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 464.52 |
| Molecular Formula: | C24 H28 N6 O4 |
| Smiles: | C\C(C1=C(c2ccc(cc2)OC)NN(C1=O)c1ccc(cc1)[N+]([O-])=O)=N/CCN1CCNCC1 |
| Stereo: | ACHIRAL |
| logP: | 2.6192 |
| logD: | 2.6192 |
| logSw: | -2.8322 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.804 |
| InChI Key: | DIIJGJVUORGPAL-UHFFFAOYSA-N |