3-[(3,4-dimethylphenyl)carbamoyl]bicyclo[2.2.2]octane-2-carboxylic acid
Chemical Structure Depiction of
3-[(3,4-dimethylphenyl)carbamoyl]bicyclo[2.2.2]octane-2-carboxylic acid
3-[(3,4-dimethylphenyl)carbamoyl]bicyclo[2.2.2]octane-2-carboxylic acid
Compound characteristics
| Compound ID: | Y206-0176 |
| Compound Name: | 3-[(3,4-dimethylphenyl)carbamoyl]bicyclo[2.2.2]octane-2-carboxylic acid |
| Molecular Weight: | 301.38 |
| Molecular Formula: | C18 H23 N O3 |
| Smiles: | Cc1ccc(cc1C)NC(C1C2CCC(CC2)C1C(O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8789 |
| logD: | 1.2589 |
| logSw: | -3.9349 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.85 |
| InChI Key: | DHERWNVDUZZBCP-UHFFFAOYSA-N |