N~2~-(5-bromothiophene-2-sulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N~2~-methylglycinamide
Chemical Structure Depiction of
N~2~-(5-bromothiophene-2-sulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N~2~-methylglycinamide
N~2~-(5-bromothiophene-2-sulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N~2~-methylglycinamide
Compound characteristics
Compound ID: | C274-3148 |
Compound Name: | N~2~-(5-bromothiophene-2-sulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N~2~-methylglycinamide |
Molecular Weight: | 490.41 |
Molecular Formula: | C16 H16 Br N3 O4 S3 |
Smiles: | CCOc1ccc2c(c1)sc(NC(CN(C)S(c1ccc(s1)[Br])(=O)=O)=O)n2 |
Stereo: | ACHIRAL |
logP: | 4.3717 |
logD: | 4.3716 |
logSw: | -4.2824 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.855 |
InChI Key: | FMZZOLCZNTUFSP-UHFFFAOYSA-N |