3-{[(4-chlorophenyl)methyl]carbamoyl}bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
Chemical Structure Depiction of
3-{[(4-chlorophenyl)methyl]carbamoyl}bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
3-{[(4-chlorophenyl)methyl]carbamoyl}bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
Compound characteristics
| Compound ID: | Y202-7955 |
| Compound Name: | 3-{[(4-chlorophenyl)methyl]carbamoyl}bicyclo[2.2.2]oct-5-ene-2-carboxylic acid |
| Molecular Weight: | 319.79 |
| Molecular Formula: | C17 H18 Cl N O3 |
| Smiles: | C1CC2C=CC1C(C2C(NCc1ccc(cc1)[Cl])=O)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5104 |
| logD: | 0.1852 |
| logSw: | -2.91 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.173 |
| InChI Key: | BHJUASNSOCANDM-UHFFFAOYSA-N |