3-methyl-4-{[(3-methyl-2-oxocyclohexylidene)methyl]amino}benzoic acid
Chemical Structure Depiction of
3-methyl-4-{[(3-methyl-2-oxocyclohexylidene)methyl]amino}benzoic acid
3-methyl-4-{[(3-methyl-2-oxocyclohexylidene)methyl]amino}benzoic acid
Compound characteristics
| Compound ID: | 6237-0448 |
| Compound Name: | 3-methyl-4-{[(3-methyl-2-oxocyclohexylidene)methyl]amino}benzoic acid |
| Molecular Weight: | 273.33 |
| Molecular Formula: | C16 H19 N O3 |
| Smiles: | CC1CCC\C(=C/Nc2ccc(cc2C)C(O)=O)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4801 |
| logD: | 1.5741 |
| logSw: | -3.5109 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.617 |
| InChI Key: | GLDFXSBXUAWNSW-JTQLQIEISA-N |