(2E)-2-cyano-3-[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-N-(3-methoxypropyl)prop-2-enamide
Chemical Structure Depiction of
(2E)-2-cyano-3-[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-N-(3-methoxypropyl)prop-2-enamide
(2E)-2-cyano-3-[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-N-(3-methoxypropyl)prop-2-enamide
Compound characteristics
| Compound ID: | IB06-7652 |
| Compound Name: | (2E)-2-cyano-3-[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-N-(3-methoxypropyl)prop-2-enamide |
| Molecular Weight: | 444.53 |
| Molecular Formula: | C26 H28 N4 O3 |
| Smiles: | CCOc1ccc(cc1C)c1c(\C=C(/C#N)C(NCCCOC)=O)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.17 |
| logD: | 4.17 |
| logSw: | -5 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 115.71 |
| InChI Key: | XDPTZVKYFZRIRY-UHFFFAOYSA-N |