3-(1-benzyl-1H-indol-3-yl)-N-(3-chlorophenyl)-2-cyanoprop-2-enamide
Chemical Structure Depiction of
3-(1-benzyl-1H-indol-3-yl)-N-(3-chlorophenyl)-2-cyanoprop-2-enamide
3-(1-benzyl-1H-indol-3-yl)-N-(3-chlorophenyl)-2-cyanoprop-2-enamide
Compound characteristics
Compound ID: | 4086-2457 |
Compound Name: | 3-(1-benzyl-1H-indol-3-yl)-N-(3-chlorophenyl)-2-cyanoprop-2-enamide |
Molecular Weight: | 411.89 |
Molecular Formula: | C25 H18 Cl N3 O |
Smiles: | C(c1ccccc1)n1cc(/C=C(/C#N)C(Nc2cccc(c2)[Cl])=O)c2ccccc12 |
Stereo: | ACHIRAL |
logP: | 5.8119 |
logD: | 5.6093 |
logSw: | -6.0533 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.118 |
InChI Key: | CRAUIMSEFRYWJG-UHFFFAOYSA-N |