3-(5-bromo-2-hydroxyphenyl)-N-[2-(2-chlorophenyl)ethyl]-2-cyanoprop-2-enamide
Chemical Structure Depiction of
3-(5-bromo-2-hydroxyphenyl)-N-[2-(2-chlorophenyl)ethyl]-2-cyanoprop-2-enamide
3-(5-bromo-2-hydroxyphenyl)-N-[2-(2-chlorophenyl)ethyl]-2-cyanoprop-2-enamide
Compound characteristics
| Compound ID: | K781-0805 |
| Compound Name: | 3-(5-bromo-2-hydroxyphenyl)-N-[2-(2-chlorophenyl)ethyl]-2-cyanoprop-2-enamide |
| Molecular Weight: | 405.68 |
| Molecular Formula: | C18 H14 Br Cl N2 O2 |
| Smiles: | C(CNC(C(=C\c1cc(ccc1O)[Br])\C#N)=O)c1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.3087 |
| logD: | 3.9534 |
| logSw: | -4.2472 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.098 |
| InChI Key: | XQDGTKCTFXWJIT-UHFFFAOYSA-N |