6-(5-bromo-2-methoxyphenyl)-5-nitropiperidin-2-one
Chemical Structure Depiction of
6-(5-bromo-2-methoxyphenyl)-5-nitropiperidin-2-one
6-(5-bromo-2-methoxyphenyl)-5-nitropiperidin-2-one
Compound characteristics
| Compound ID: | K813-0177 |
| Compound Name: | 6-(5-bromo-2-methoxyphenyl)-5-nitropiperidin-2-one |
| Molecular Weight: | 329.15 |
| Molecular Formula: | C12 H13 Br N2 O4 |
| Smiles: | COc1ccc(cc1C1C(CCC(N1)=O)[N+]([O-])=O)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.8965 |
| logD: | 0.9674 |
| logSw: | -2.6501 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.89 |
| InChI Key: | GYNLENYWMBGSAY-UHFFFAOYSA-N |