Amidoquine
4-(dimethylamino)-1,5-dimethyl-2-phenylpyrazol-3-one;(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol;1,3,7-trimethylpurine-2,6-dione;hydrochloride
Also Known As: Amidoquine|Amidochina|Amidochin|Cinchonan-9-ol, 6'-methoxy-, monohydrochloride, (8alpha,9R)-, mixt. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione and 4-(dimethylamino)-1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one|4-(dimethylamino)-1,5-dimethyl-2-phenylpyrazol-3-one; (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol; 1,3,7-trimethylpurine-2,6-dione; hydrochloride
| Molecular Formula | C41H52ClN9O5 |
|---|---|
| Molecular Weight | 785.378 g/mol |
| LogP | 4.11612 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 785.378 |
| Monoisotopic Mass | 785.378 |
| Heavy Atoms | 56 |
| Complexity | 1090.0 |
Chemical Identifiers
| CAS Number | 8075-61-4 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)C.CN1C=NC2=C1C(=O)N(C(=O)N2C)C.COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O.Cl |
| InChIKey | ODOPLLNPLYGBPQ-UHFFFAOYSA-N |
Product Overview
Amidoquine (CAS 8075-61-4), with molecular formula C41H52ClN9O5 and molecular weight 785.378 g/mol. IUPAC: 4-(dimethylamino)-1,5-dimethyl-2-phenylpyrazol-3-one;(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol;1,3,7-trimethylpurine-2,6-dione;hydrochloride.