Alinastine
2-[1-[2-(4-tert-butylphenyl)ethyl]piperidin-4-yl]-1-(2-ethoxyethyl)benzimidazole
Also Known As: Alinastine|Alinastina|Alinastine [INN]|J1.090.369F|US10106522, Example 5 in EP 0580541|2-[1-[2-(4-tert-butylphenyl)ethyl]piperidin-4-yl]-1-(2-ethoxyethyl)benzimidazole|2-(1-(p-tert-Butylphenethyl)-4-piperidyl)-1-(2-ethoxyethyl)benzimidazole|Benzimidazole, 2-(1-(p-tert-butylphenethyl)-4-piperidyl)-1-(2-ethoxyethyl)-|2-(1-(p-tert-Bytylphenethyl)-4-piperidyl)-1-(2-ethoxyethyl)benzimidazole|2-[1-[2-(4-tert-butylphenyl)ethyl]piperidin-4-yl]-1-(2-ethox|2-(1-(2-(4-(1,1-dimethylethyl)phenyl)ethyl)piperidin-4-yl)-1-(2-ethoxyethyl)-1H-benzimidazole|1-(2-Ethoxyethyl)-2-[1-[2-(4-tert-butylphenyl)ethyl]piperidine-4-yl]-1H-benzimidazole|2-{1-[2-(4-tert-Butylphenyl)ethyl]piperidin-4-yl}-1-(2-ethoxyethyl)-1H-1,3-benzimidazole|2-{1-[2-(4-tert-butylphenyl)ethyl]piperidin-4-yl}-1-(2-ethoxyethyl)-1H-1,3-benzodiazole
| Molecular Formula | C28H39N3O |
|---|---|
| Molecular Weight | 433.30933 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 30.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 433.30933 |
| Monoisotopic Mass | 433.30933 |
| Heavy Atoms | 32 |
| Complexity | 545.0 |
Chemical Identifiers
| CAS Number | 214558-72-2 |
|---|---|
| SMILES | CCOCCN1C2=CC=CC=C2N=C1C3CCN(CC3)CCC4=CC=C(C=C4)C(C)(C)C |
| InChIKey | NPWTVYBPSXCRPM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Alinastine (CAS 214558-72-2), with molecular formula C28H39N3O and molecular weight 433.30933 g/mol. IUPAC: 2-[1-[2-(4-tert-butylphenyl)ethyl]piperidin-4-yl]-1-(2-ethoxyethyl)benzimidazole.
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