N-(1-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-3-{[3-(1H-imidazol-1-yl)propyl]amino}-3-oxoprop-1-en-2-yl)benzamide
Chemical Structure Depiction of
N-(1-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-3-{[3-(1H-imidazol-1-yl)propyl]amino}-3-oxoprop-1-en-2-yl)benzamide
N-(1-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-3-{[3-(1H-imidazol-1-yl)propyl]amino}-3-oxoprop-1-en-2-yl)benzamide
Compound characteristics
| Compound ID: | 2556-2079 |
| Compound Name: | N-(1-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-3-{[3-(1H-imidazol-1-yl)propyl]amino}-3-oxoprop-1-en-2-yl)benzamide |
| Molecular Weight: | 551.05 |
| Molecular Formula: | C31 H27 Cl N6 O2 |
| Smiles: | [H]C(=C(/C(N([H])CCCn1ccnc1)=O)N([H])C(c1ccccc1)=O)\c1cn(c2ccccc2)nc1c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.2319 |
| logD: | 3.4151 |
| logSw: | -4.6534 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.851 |
| InChI Key: | UKCZEEULTPCXMO-UHFFFAOYSA-N |