3-[1-(2-methylbenzene-1-sulfonyl)piperidin-4-yl]propanoic acid
Chemical Structure Depiction of
3-[1-(2-methylbenzene-1-sulfonyl)piperidin-4-yl]propanoic acid
3-[1-(2-methylbenzene-1-sulfonyl)piperidin-4-yl]propanoic acid
Compound characteristics
| Compound ID: | M306-1837 |
| Compound Name: | 3-[1-(2-methylbenzene-1-sulfonyl)piperidin-4-yl]propanoic acid |
| Molecular Weight: | 311.4 |
| Molecular Formula: | C15 H21 N O4 S |
| Smiles: | Cc1ccccc1S(N1CCC(CCC(O)=O)CC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0098 |
| logD: | -0.8183 |
| logSw: | -2.1536 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.333 |
| InChI Key: | SNTUPIMVSQFIRR-UHFFFAOYSA-N |