4-[(4-chlorophenyl)methylidene]-5-(morpholin-4-yl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(4-chlorophenyl)methylidene]-5-(morpholin-4-yl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
4-[(4-chlorophenyl)methylidene]-5-(morpholin-4-yl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8006-3472 |
| Compound Name: | 4-[(4-chlorophenyl)methylidene]-5-(morpholin-4-yl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 412.83 |
| Molecular Formula: | C20 H17 Cl N4 O4 |
| Smiles: | C1COCCN1C1/C(=C\c2ccc(cc2)[Cl])C(N(c2ccc(cc2)[N+]([O-])=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6257 |
| logD: | 3.6256 |
| logSw: | -4.2496 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.474 |
| InChI Key: | HWLFXXQFOWNYRC-UHFFFAOYSA-N |