ethyl 3-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamido)benzoate
Chemical Structure Depiction of
ethyl 3-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamido)benzoate
ethyl 3-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamido)benzoate
Compound characteristics
Compound ID: | E613-0229 |
Compound Name: | ethyl 3-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamido)benzoate |
Molecular Weight: | 424.41 |
Molecular Formula: | C22 H20 N2 O7 |
Smiles: | CCOC(c1cccc(c1)NC(COCc1cc(c2ccc3c(c2)OCO3)on1)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1596 |
logD: | 4.1595 |
logSw: | -4.3001 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 91.45 |
InChI Key: | OQFKHZKEAGBYAL-UHFFFAOYSA-N |