N-{3-(benzylamino)-1-[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
Chemical Structure Depiction of
N-{3-(benzylamino)-1-[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
N-{3-(benzylamino)-1-[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
Compound characteristics
| Compound ID: | 1502-1559 |
| Compound Name: | N-{3-(benzylamino)-1-[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide |
| Molecular Weight: | 530.6 |
| Molecular Formula: | C33 H27 F N4 O2 |
| Smiles: | Cc1ccc(cc1)C(NC(=C/c1cn(c2ccccc2)nc1c1ccc(cc1)F)\C(NCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9471 |
| logD: | 5.3581 |
| logSw: | -5.5357 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.209 |
| InChI Key: | CTSGRSJOYDOUHR-UHFFFAOYSA-N |