3-{3-chloro-5-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
Chemical Structure Depiction of
3-{3-chloro-5-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
3-{3-chloro-5-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
Compound characteristics
| Compound ID: | 5609-0505 |
| Compound Name: | 3-{3-chloro-5-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide |
| Molecular Weight: | 447.92 |
| Molecular Formula: | C25 H22 Cl N3 O3 |
| Smiles: | CCOc1cc(\C=C(/C#N)C(NCCc2c[nH]c3ccccc23)=O)cc(c1OCC#C)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5391 |
| logD: | 4.5391 |
| logSw: | -4.6865 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.221 |
| InChI Key: | FYICKUBYNMPQDS-UHFFFAOYSA-N |