potassium--7-oxo-2-[(pyridin-3-yl)methyl]azepane-2-carboxylate (1/1)
Chemical Structure Depiction of
potassium--7-oxo-2-[(pyridin-3-yl)methyl]azepane-2-carboxylate (1/1)
potassium--7-oxo-2-[(pyridin-3-yl)methyl]azepane-2-carboxylate (1/1)
Compound characteristics
| Compound ID: | S515-0820 |
| Compound Name: | potassium--7-oxo-2-[(pyridin-3-yl)methyl]azepane-2-carboxylate (1/1) |
| Molecular Weight: | 286.37 |
| Molecular Formula: | C13 H15 N2 O3 |
| Salt: | K+ |
| Smiles: | C1CCC(Cc2cccnc2)(C([O-])=O)NC(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.0205 |
| logD: | -0.0206 |
| logSw: | -1.0759 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.267 |
| InChI Key: | FZPDUOMMWPIZAE-CYBMUJFWSA-M |