3-{[2-(2-methoxyphenyl)ethyl]carbamoyl}bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
Chemical Structure Depiction of
3-{[2-(2-methoxyphenyl)ethyl]carbamoyl}bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
3-{[2-(2-methoxyphenyl)ethyl]carbamoyl}bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
Compound characteristics
| Compound ID: | Y206-4431 |
| Compound Name: | 3-{[2-(2-methoxyphenyl)ethyl]carbamoyl}bicyclo[2.2.2]oct-5-ene-2-carboxylic acid |
| Molecular Weight: | 329.39 |
| Molecular Formula: | C19 H23 N O4 |
| Smiles: | COc1ccccc1CCNC(C1C2CCC(C=C2)C1C(O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.375 |
| logD: | 0.0499 |
| logSw: | -2.5764 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.645 |
| InChI Key: | WOTFTNIPEGTJOP-UHFFFAOYSA-N |