3-methyl-5-(4-methylpiperidine-1-sulfonyl)-1-benzofuran-2-carboxylic acid
Chemical Structure Depiction of
3-methyl-5-(4-methylpiperidine-1-sulfonyl)-1-benzofuran-2-carboxylic acid
3-methyl-5-(4-methylpiperidine-1-sulfonyl)-1-benzofuran-2-carboxylic acid
Compound characteristics
| Compound ID: | R152-2093 |
| Compound Name: | 3-methyl-5-(4-methylpiperidine-1-sulfonyl)-1-benzofuran-2-carboxylic acid |
| Molecular Weight: | 337.39 |
| Molecular Formula: | C16 H19 N O5 S |
| Smiles: | CC1CCN(CC1)S(c1ccc2c(c1)c(C)c(C(O)=O)o2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9414 |
| logD: | -1.4414 |
| logSw: | -3.0872 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.883 |
| InChI Key: | MXVRNKDGJMMDJI-UHFFFAOYSA-N |