N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-amine
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-amine
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-amine
Compound characteristics
| Compound ID: | E713-0077 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-amine |
| Molecular Weight: | 355.35 |
| Molecular Formula: | C18 H17 N3 O5 |
| Smiles: | COc1ccc(cc1OC)c1nc(NCc2ccc3c(c2)OCO3)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.1515 |
| logD: | 3.1515 |
| logSw: | -3.2196 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.839 |
| InChI Key: | OSGSZZIHXTWROL-UHFFFAOYSA-N |