3-(5-bromo-2-hydroxyphenyl)-N-[(3-chlorophenyl)methyl]-2-cyanoprop-2-enamide
Chemical Structure Depiction of
3-(5-bromo-2-hydroxyphenyl)-N-[(3-chlorophenyl)methyl]-2-cyanoprop-2-enamide
3-(5-bromo-2-hydroxyphenyl)-N-[(3-chlorophenyl)methyl]-2-cyanoprop-2-enamide
Compound characteristics
Compound ID: | K781-0806 |
Compound Name: | 3-(5-bromo-2-hydroxyphenyl)-N-[(3-chlorophenyl)methyl]-2-cyanoprop-2-enamide |
Molecular Weight: | 391.65 |
Molecular Formula: | C17 H12 Br Cl N2 O2 |
Smiles: | C(c1cccc(c1)[Cl])NC(C(=C\c1cc(ccc1O)[Br])\C#N)=O |
Stereo: | ACHIRAL |
logP: | 4.2356 |
logD: | 3.8803 |
logSw: | -4.3199 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 58.256 |
InChI Key: | OOZJALHAIPMZEW-UHFFFAOYSA-N |