3-[1-(4-methylbenzene-1-sulfonyl)piperidin-3-yl]propanoic acid
Chemical Structure Depiction of
3-[1-(4-methylbenzene-1-sulfonyl)piperidin-3-yl]propanoic acid
3-[1-(4-methylbenzene-1-sulfonyl)piperidin-3-yl]propanoic acid
Compound characteristics
| Compound ID: | M305-2194 |
| Compound Name: | 3-[1-(4-methylbenzene-1-sulfonyl)piperidin-3-yl]propanoic acid |
| Molecular Weight: | 311.4 |
| Molecular Formula: | C15 H21 N O4 S |
| Smiles: | Cc1ccc(cc1)S(N1CCCC(CCC(O)=O)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0472 |
| logD: | -0.781 |
| logSw: | -2.4307 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.267 |
| InChI Key: | XIHNEHWTBWQXJD-CYBMUJFWSA-N |