N-{3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-1-(4-fluorophenyl)-3-oxoprop-1-en-2-yl}benzamide
Chemical Structure Depiction of
N-{3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-1-(4-fluorophenyl)-3-oxoprop-1-en-2-yl}benzamide
N-{3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-1-(4-fluorophenyl)-3-oxoprop-1-en-2-yl}benzamide
Compound characteristics
| Compound ID: | 3236-0038 |
| Compound Name: | N-{3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-1-(4-fluorophenyl)-3-oxoprop-1-en-2-yl}benzamide |
| Molecular Weight: | 470.5 |
| Molecular Formula: | C27 H23 F N4 O3 |
| Smiles: | [H]C(=C(/C(NC1=C(C)N(C)N(C1=O)c1ccccc1)=O)N([H])C(c1ccccc1)=O)\c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 2.7758 |
| logD: | 1.3296 |
| logSw: | -3.3311 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.635 |
| InChI Key: | WSMOUQRGNGMIDP-QJOMJCCJSA-N |