3-(adamantan-1-yl)-5-[(phenylcarbamoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Chemical Structure Depiction of
3-(adamantan-1-yl)-5-[(phenylcarbamoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
3-(adamantan-1-yl)-5-[(phenylcarbamoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Compound characteristics
| Compound ID: | 4226-0890 |
| Compound Name: | 3-(adamantan-1-yl)-5-[(phenylcarbamoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide |
| Molecular Weight: | 338.41 |
| Molecular Formula: | C19 H22 N4 O2 |
| Smiles: | [H][C-]1\C(=N/C(Nc2ccccc2)=O)ON=[N+]1C12CC3CC(CC(C3)C2)C1 |
| Stereo: | ACHIRAL |
| logP: | 3.1008 |
| logD: | 3.091 |
| logSw: | -3.4374 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.535 |
| InChI Key: | GSRHVYJAWVJFNP-UHFFFAOYSA-N |