methyl 1-[2-methoxy-5-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonyl]piperidine-4-carboxylate
Chemical Structure Depiction of
methyl 1-[2-methoxy-5-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonyl]piperidine-4-carboxylate
methyl 1-[2-methoxy-5-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonyl]piperidine-4-carboxylate
Compound characteristics
Compound ID: | D470-0206 |
Compound Name: | methyl 1-[2-methoxy-5-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonyl]piperidine-4-carboxylate |
Molecular Weight: | 446.5 |
Molecular Formula: | C17 H22 N2 O8 S2 |
Smiles: | COC(C1CCN(CC1)S(c1cc(ccc1OC)N1C(CCS1(=O)=O)=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | -0.0136 |
logD: | -0.0136 |
logSw: | -2.139 |
Hydrogen bond acceptors count: | 15 |
Polar surface area: | 106.171 |
InChI Key: | XBNDSXZPEGQAHM-UHFFFAOYSA-N |