3-(2-phenylethyl)-5-[(3,4,5-trimethoxybenzoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Chemical Structure Depiction of
3-(2-phenylethyl)-5-[(3,4,5-trimethoxybenzoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
3-(2-phenylethyl)-5-[(3,4,5-trimethoxybenzoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Compound characteristics
| Compound ID: | 8011-9260 |
| Compound Name: | 3-(2-phenylethyl)-5-[(3,4,5-trimethoxybenzoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide |
| Molecular Weight: | 383.4 |
| Molecular Formula: | C20 H21 N3 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)C(/N=C1\[C-][N+](CCc2ccccc2)=NO1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9996 |
| logD: | 1.9996 |
| logSw: | -2.4675 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 75.575 |
| InChI Key: | OYWSMTBBZRLPPW-UHFFFAOYSA-N |