5-(carbamoylimino)-3-(1-phenylpropan-2-yl)-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Chemical Structure Depiction of
5-(carbamoylimino)-3-(1-phenylpropan-2-yl)-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
5-(carbamoylimino)-3-(1-phenylpropan-2-yl)-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Compound characteristics
| Compound ID: | 4900-0056 |
| Compound Name: | 5-(carbamoylimino)-3-(1-phenylpropan-2-yl)-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide |
| Molecular Weight: | 246.27 |
| Molecular Formula: | C12 H14 N4 O2 |
| Smiles: | CC(Cc1ccccc1)[N+]1[C-]\C(=N/C(N)=O)ON=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0995 |
| logD: | 1.0917 |
| logSw: | -1.5258 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.517 |
| InChI Key: | OHFQDERPENOZNC-VIFPVBQESA-N |