rel-(1R,2S)-2-{[(pyridin-3-yl)methyl]carbamoyl}cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
rel-(1R,2S)-2-{[(pyridin-3-yl)methyl]carbamoyl}cyclohexane-1-carboxylic acid
rel-(1R,2S)-2-{[(pyridin-3-yl)methyl]carbamoyl}cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | 6415-0432 |
| Compound Name: | rel-(1R,2S)-2-{[(pyridin-3-yl)methyl]carbamoyl}cyclohexane-1-carboxylic acid |
| Molecular Weight: | 262.31 |
| Molecular Formula: | C14 H18 N2 O3 |
| Smiles: | C1CC[C@@H](C(NCc2cccnc2)=O)[C@H](C1)C(O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.4452 |
| logD: | -2.2055 |
| logSw: | -1.4086 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.77 |
| InChI Key: | XOLCGPJCJZCOSE-NEPJUHHUSA-N |