3,4-dimethyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]cyclohex-3-ene-1-carboxylic acid
Chemical Structure Depiction of
3,4-dimethyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]cyclohex-3-ene-1-carboxylic acid
3,4-dimethyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]cyclohex-3-ene-1-carboxylic acid
Compound characteristics
| Compound ID: | Y206-4626 |
| Compound Name: | 3,4-dimethyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]cyclohex-3-ene-1-carboxylic acid |
| Molecular Weight: | 344.41 |
| Molecular Formula: | C18 H24 N4 O3 |
| Smiles: | CC1CC(C(CC=1C)C(N1CCN(CC1)c1ncccn1)=O)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.6258 |
| logD: | -0.73 |
| logSw: | -2.1971 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.11 |
| InChI Key: | XZUUOKOAXZEXAK-UHFFFAOYSA-N |