N-(4-ethoxyphenyl)-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]acetamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]acetamide
N-(4-ethoxyphenyl)-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]acetamide
Compound characteristics
Compound ID: | F943-2024 |
Compound Name: | N-(4-ethoxyphenyl)-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]acetamide |
Molecular Weight: | 461.56 |
Molecular Formula: | C21 H23 N3 O5 S2 |
Smiles: | CCOc1ccc(cc1)NC(CN1C(=O)Sc2cc(ccc12)S(N1CCCC1)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7748 |
logD: | 3.7748 |
logSw: | -3.9684 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.161 |
InChI Key: | MMBVDDQZQXGILS-UHFFFAOYSA-N |