methyl 2-{2-[2-methyl-4-(pyrrolidine-1-sulfonyl)phenoxy]acetamido}benzoate
Chemical Structure Depiction of
methyl 2-{2-[2-methyl-4-(pyrrolidine-1-sulfonyl)phenoxy]acetamido}benzoate
methyl 2-{2-[2-methyl-4-(pyrrolidine-1-sulfonyl)phenoxy]acetamido}benzoate
Compound characteristics
| Compound ID: | Y050-0730 |
| Compound Name: | methyl 2-{2-[2-methyl-4-(pyrrolidine-1-sulfonyl)phenoxy]acetamido}benzoate |
| Molecular Weight: | 432.49 |
| Molecular Formula: | C21 H24 N2 O6 S |
| Smiles: | Cc1cc(ccc1OCC(Nc1ccccc1C(=O)OC)=O)S(N1CCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2251 |
| logD: | 3.2065 |
| logSw: | -3.6365 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.255 |
| InChI Key: | VTKLJXCBXOTXLU-UHFFFAOYSA-N |