4-(3-bromo-4-methylanilino)-2-[(4-chlorophenyl)methyl]-4-oxobutanoic acid
Chemical Structure Depiction of
4-(3-bromo-4-methylanilino)-2-[(4-chlorophenyl)methyl]-4-oxobutanoic acid
4-(3-bromo-4-methylanilino)-2-[(4-chlorophenyl)methyl]-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 8015-4177 |
| Compound Name: | 4-(3-bromo-4-methylanilino)-2-[(4-chlorophenyl)methyl]-4-oxobutanoic acid |
| Molecular Weight: | 410.69 |
| Molecular Formula: | C18 H17 Br Cl N O3 |
| Smiles: | Cc1ccc(cc1[Br])NC(CC(Cc1ccc(cc1)[Cl])C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5852 |
| logD: | 1.931 |
| logSw: | -4.456 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.524 |
| InChI Key: | ZZBQFVQJWMMHSU-CYBMUJFWSA-N |