3-[4-(3-chlorophenyl)piperazine-1-carbonyl]bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
Chemical Structure Depiction of
3-[4-(3-chlorophenyl)piperazine-1-carbonyl]bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
3-[4-(3-chlorophenyl)piperazine-1-carbonyl]bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
Compound characteristics
| Compound ID: | Y206-6386 |
| Compound Name: | 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]bicyclo[2.2.2]oct-5-ene-2-carboxylic acid |
| Molecular Weight: | 374.87 |
| Molecular Formula: | C20 H23 Cl N2 O3 |
| Smiles: | C1CC2C=CC1C(C2C(N1CCN(CC1)c1cccc(c1)[Cl])=O)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9811 |
| logD: | 0.656 |
| logSw: | -3.2002 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.668 |
| InChI Key: | DZUJQBDSCVJZSY-UHFFFAOYSA-N |