2-(4-chlorobenzene-1-sulfonyl)-N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
Chemical Structure Depiction of
2-(4-chlorobenzene-1-sulfonyl)-N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
2-(4-chlorobenzene-1-sulfonyl)-N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
Compound characteristics
Compound ID: | G856-7220 |
Compound Name: | 2-(4-chlorobenzene-1-sulfonyl)-N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide |
Molecular Weight: | 412.91 |
Molecular Formula: | C17 H17 Cl N2 O4 S2 |
Smiles: | CC1(C)CC(c2c(C1)nc(NC(CS(c1ccc(cc1)[Cl])(=O)=O)=O)s2)=O |
Stereo: | ACHIRAL |
logP: | 3.1174 |
logD: | 2.7343 |
logSw: | -3.6139 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.868 |
InChI Key: | QAMSBQQUAKBBNS-UHFFFAOYSA-N |