methyl 6-{2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]acetamido}-2H-1,3-benzodioxole-5-carboxylate
Chemical Structure Depiction of
methyl 6-{2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]acetamido}-2H-1,3-benzodioxole-5-carboxylate
methyl 6-{2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]acetamido}-2H-1,3-benzodioxole-5-carboxylate
Compound characteristics
| Compound ID: | E554-0267 |
| Compound Name: | methyl 6-{2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]acetamido}-2H-1,3-benzodioxole-5-carboxylate |
| Molecular Weight: | 411.37 |
| Molecular Formula: | C20 H17 N3 O7 |
| Smiles: | COC(c1cc2c(cc1NC(Cc1nc(c3ccc(cc3)OC)no1)=O)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2097 |
| logD: | 3.0245 |
| logSw: | -3.5296 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.594 |
| InChI Key: | PRWFVZSARYRAMH-UHFFFAOYSA-N |