6-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-6-oxohexanoic acid
Chemical Structure Depiction of
6-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-6-oxohexanoic acid
6-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-6-oxohexanoic acid
Compound characteristics
Compound ID: | 3003-0930 |
Compound Name: | 6-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-6-oxohexanoic acid |
Molecular Weight: | 322.38 |
Molecular Formula: | C15 H18 N2 O4 S |
Smiles: | CCOc1ccc2c(c1)sc(NC(CCCCC(O)=O)=O)n2 |
Stereo: | ACHIRAL |
logP: | 2.2864 |
logD: | -0.5418 |
logSw: | -2.8454 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.657 |
InChI Key: | SEQIYDWLRWGHBG-UHFFFAOYSA-N |