3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid
Chemical Structure Depiction of
3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid
3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid
Compound characteristics
| Compound ID: | Y204-2988 |
| Compound Name: | 3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid |
| Molecular Weight: | 376.88 |
| Molecular Formula: | C20 H25 Cl N2 O3 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(C1C2CCC(C2)C1C(O)=O)=O)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.351 |
| logD: | 0.731 |
| logSw: | -3.3914 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.099 |
| InChI Key: | JYQRMPDBYSTUDA-UHFFFAOYSA-N |