2-cyano-3-(2-methyl-2H-1-benzopyran-3-yl)-N-(4-methylphenyl)prop-2-enamide
Chemical Structure Depiction of
2-cyano-3-(2-methyl-2H-1-benzopyran-3-yl)-N-(4-methylphenyl)prop-2-enamide
2-cyano-3-(2-methyl-2H-1-benzopyran-3-yl)-N-(4-methylphenyl)prop-2-enamide
Compound characteristics
Compound ID: | 4578-0433 |
Compound Name: | 2-cyano-3-(2-methyl-2H-1-benzopyran-3-yl)-N-(4-methylphenyl)prop-2-enamide |
Molecular Weight: | 330.38 |
Molecular Formula: | C21 H18 N2 O2 |
Smiles: | CC1C(\C=C(/C#N)C(Nc2ccc(C)cc2)=O)=Cc2ccccc2O1 |
Stereo: | RACEMIC MIXTURE |
logP: | 4.7881 |
logD: | 4.724 |
logSw: | -4.5544 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.037 |
InChI Key: | OFZSVYNIWBWBQO-BRFSQIRFSA-N |