4-{[(4-methylphenyl)methyl]amino}-4-oxobutanoic acid
Chemical Structure Depiction of
4-{[(4-methylphenyl)methyl]amino}-4-oxobutanoic acid
4-{[(4-methylphenyl)methyl]amino}-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 6049-1524 |
| Compound Name: | 4-{[(4-methylphenyl)methyl]amino}-4-oxobutanoic acid |
| Molecular Weight: | 221.25 |
| Molecular Formula: | C12 H15 N O3 |
| Smiles: | Cc1ccc(CNC(CCC(O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 0.9132 |
| logD: | -2.0362 |
| logSw: | -1.7259 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.094 |
| InChI Key: | ZOFINSCQWDRGSZ-UHFFFAOYSA-N |