5-(acetylimino)-3-[2-(3,4-dimethoxyphenyl)ethyl]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Chemical Structure Depiction of
5-(acetylimino)-3-[2-(3,4-dimethoxyphenyl)ethyl]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
5-(acetylimino)-3-[2-(3,4-dimethoxyphenyl)ethyl]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Compound characteristics
| Compound ID: | 8013-1955 |
| Compound Name: | 5-(acetylimino)-3-[2-(3,4-dimethoxyphenyl)ethyl]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide |
| Molecular Weight: | 291.3 |
| Molecular Formula: | C14 H17 N3 O4 |
| Smiles: | [H][C-]1\C(=N/C(C)=O)ON=[N+]1CCc1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 0.2983 |
| logD: | 0.2983 |
| logSw: | -1.6288 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.028 |
| InChI Key: | KMOUADCWLYFJQG-UHFFFAOYSA-N |