6-{4-[(4-chlorophenyl)methyl]piperazine-1-carbonyl}cyclohex-3-ene-1-carboxylic acid
Chemical Structure Depiction of
6-{4-[(4-chlorophenyl)methyl]piperazine-1-carbonyl}cyclohex-3-ene-1-carboxylic acid
6-{4-[(4-chlorophenyl)methyl]piperazine-1-carbonyl}cyclohex-3-ene-1-carboxylic acid
Compound characteristics
| Compound ID: | Y205-9936 |
| Compound Name: | 6-{4-[(4-chlorophenyl)methyl]piperazine-1-carbonyl}cyclohex-3-ene-1-carboxylic acid |
| Molecular Weight: | 362.85 |
| Molecular Formula: | C19 H23 Cl N2 O3 |
| Smiles: | C1C=CCC(C1C(O)=O)C(N1CCN(CC1)Cc1ccc(cc1)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3665 |
| logD: | 0.0107 |
| logSw: | -2.8875 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.028 |
| InChI Key: | CMRMAQFDMFBWPC-UHFFFAOYSA-N |