4-(3-chloro-2-methylanilino)-3-[(3-methylphenyl)methyl]-4-oxobutanoic acid
Chemical Structure Depiction of
4-(3-chloro-2-methylanilino)-3-[(3-methylphenyl)methyl]-4-oxobutanoic acid
4-(3-chloro-2-methylanilino)-3-[(3-methylphenyl)methyl]-4-oxobutanoic acid
Compound characteristics
Compound ID: | 2257-0501 |
Compound Name: | 4-(3-chloro-2-methylanilino)-3-[(3-methylphenyl)methyl]-4-oxobutanoic acid |
Molecular Weight: | 345.82 |
Molecular Formula: | C19 H20 Cl N O3 |
Smiles: | Cc1cccc(CC(CC(O)=O)C(Nc2cccc(c2C)[Cl])=O)c1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.9765 |
logD: | 1.3303 |
logSw: | -3.8228 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 51.016 |
InChI Key: | SUOYQYMDKFKTDK-OAHLLOKOSA-N |