2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]acetamide
Chemical Structure Depiction of
2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]acetamide
2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]acetamide
Compound characteristics
Compound ID: | D038-1080 |
Compound Name: | 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]acetamide |
Molecular Weight: | 414.5 |
Molecular Formula: | C20 H18 N2 O4 S2 |
Smiles: | [H]N(C(Cc1coc2c(C)c(C)ccc12)=O)c1nc2ccc(cc2s1)S(C)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7518 |
logD: | 3.7513 |
logSw: | -3.9943 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.419 |
InChI Key: | XOCGRHOSHDGKHL-UHFFFAOYSA-N |