2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}-N-(4-chloro-2,5-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}-N-(4-chloro-2,5-dimethoxyphenyl)acetamide
2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}-N-(4-chloro-2,5-dimethoxyphenyl)acetamide
Compound characteristics
Compound ID: | E613-0100 |
Compound Name: | 2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}-N-(4-chloro-2,5-dimethoxyphenyl)acetamide |
Molecular Weight: | 446.84 |
Molecular Formula: | C21 H19 Cl N2 O7 |
Smiles: | COc1cc(c(cc1NC(COCc1cc(c2ccc3c(c2)OCO3)on1)=O)OC)[Cl] |
Stereo: | ACHIRAL |
logP: | 3.6663 |
logD: | 3.5837 |
logSw: | -4.066 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 85.259 |
InChI Key: | YGKSWCVRPBLLMC-UHFFFAOYSA-N |