propan-2-yl 2-(3,4-dimethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-(3,4-dimethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
propan-2-yl 2-(3,4-dimethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
Compound ID: | 8011-9426 |
Compound Name: | propan-2-yl 2-(3,4-dimethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
Molecular Weight: | 403.5 |
Molecular Formula: | C21 H25 N O5 S |
Smiles: | CC(C)OC(c1c2CCCCc2sc1NC(c1ccc(c(c1)OC)OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.274 |
logD: | 1.5502 |
logSw: | -4.5164 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.738 |
InChI Key: | SKSXXESXTVWIKU-UHFFFAOYSA-N |