rel-(2R,3R)-2-(2H-1,3-benzodioxol-5-yl)-1-ethyl-6-oxopiperidine-3-carboxylic acid
Chemical Structure Depiction of
rel-(2R,3R)-2-(2H-1,3-benzodioxol-5-yl)-1-ethyl-6-oxopiperidine-3-carboxylic acid
rel-(2R,3R)-2-(2H-1,3-benzodioxol-5-yl)-1-ethyl-6-oxopiperidine-3-carboxylic acid
Compound characteristics
| Compound ID: | 8018-8676 |
| Compound Name: | rel-(2R,3R)-2-(2H-1,3-benzodioxol-5-yl)-1-ethyl-6-oxopiperidine-3-carboxylic acid |
| Molecular Weight: | 291.3 |
| Molecular Formula: | C15 H17 N O5 |
| Smiles: | CCN1C(CC[C@@H](C(O)=O)[C@@H]1c1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3053 |
| logD: | -0.8347 |
| logSw: | -2.4542 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.72 |
| InChI Key: | BOZVIGNUVANQSH-QMTHXVAHSA-N |