3-(1-phenylpropan-2-yl)-5-[(3,4,5-trimethoxybenzoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Chemical Structure Depiction of
3-(1-phenylpropan-2-yl)-5-[(3,4,5-trimethoxybenzoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
3-(1-phenylpropan-2-yl)-5-[(3,4,5-trimethoxybenzoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Compound characteristics
| Compound ID: | 8011-9264 |
| Compound Name: | 3-(1-phenylpropan-2-yl)-5-[(3,4,5-trimethoxybenzoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide |
| Molecular Weight: | 397.43 |
| Molecular Formula: | C21 H23 N3 O5 |
| Smiles: | CC(Cc1ccccc1)[N+]1[C-]\C(=N/C(c2cc(c(c(c2)OC)OC)OC)=O)ON=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6367 |
| logD: | 2.6367 |
| logSw: | -3.0646 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.526 |
| InChI Key: | CHLUEHQJBYCJFB-AWEZNQCLSA-N |