3-[2-(4-hydroxyphenyl)ethyl]-5-[(phenylcarbamoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-[2-(4-hydroxyphenyl)ethyl]-5-[(phenylcarbamoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide--hydrogen chloride (1/1)
3-[2-(4-hydroxyphenyl)ethyl]-5-[(phenylcarbamoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8018-8923 |
| Compound Name: | 3-[2-(4-hydroxyphenyl)ethyl]-5-[(phenylcarbamoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide--hydrogen chloride (1/1) |
| Molecular Weight: | 360.8 |
| Molecular Formula: | C17 H16 N4 O3 |
| Salt: | HCl |
| Smiles: | [C-]1/C(=N/C(Nc2ccccc2)=O)ON=[N+]1CCc1ccc(cc1)O |
| Stereo: | ACHIRAL |
| logP: | 1.4683 |
| logD: | 1.4669 |
| logSw: | -1.822 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.425 |
| InChI Key: | SJQXZHPJOCRPDY-MNDPQUGUSA-N |