N1-(6-Methoxy-8-quinolyl)-1,4-pentanediamine - CAS 525-61-1
Catalog: |
BB027868 |
Product Name: |
N1-(6-Methoxy-8-quinolyl)-1,4-pentanediamine |
CAS: |
525-61-1 |
Synonyms: |
N1-(6-methoxy-8-quinolinyl)pentane-1,4-diamine; 1-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine |
IUPAC Name: | 1-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine |
Description: | N1-(6-Methoxy-8-quinolyl)-1,4-pentanediamine (CAS# 525-61-1) is an impurity of Primaquine (P733505). Primaquine is an important antimalarial drug. |
Molecular Weight: | 259.35 |
Molecular Formula: | C15H21N3O |
Canonical SMILES: | CC(CCCNC1=C2C(=CC(=C1)OC)C=CC=N2)N |
InChI: | InChI=1S/C15H21N3O/c1-11(16)5-3-7-17-14-10-13(19-2)9-12-6-4-8-18-15(12)14/h4,6,8-11,17H,3,5,7,16H2,1-2H3 |
InChI Key: | NBAFIBBHADOTMU-UHFFFAOYSA-N |
Boiling Point: | 451.1 °C at 760 mmHg |
Density: | 1.126 g/cm3 |
LogP: | 3.55600 |
Publication Number | Title | Priority Date |
US-10980756-B1 | Methods of treatment | 20200316 |
WO-2021188564-A1 | Methods of treating covid-19 with a niclosamide compound | 20200316 |
KR-20210065519-A | Composition comprising primaquine and use thereof | 20191127 |
US-2021114973-A1 | Pharmaceutical formulations | 20191018 |
WO-2021076922-A1 | Pharmaceutical formulations | 20191018 |
PMID | Publication Date | Title | Journal |
20943339 | 20110220 | Enantiomeric separation of antimalarial drugs by capillary electrophoresis using neutral and negatively charged cyclodextrins | Journal of pharmaceutical and biomedical analysis |
19650150 | 20100401 | Capillary electrophoretic separation and computational modeling of inclusion complexes of beta-cyclodextrin and 18-crown-6 ether with primaquine and quinocide | Biomedical chromatography : BMC |
19016231 | 20090501 | Determination of quinocide as impurity in primaquine tablets by capillary zone electrophoresis | Biomedical chromatography : BMC |
18816453 | 20090301 | Enantioselective analysis of primaquine and its impurity quinocide by capillary electrophoresis | Biomedical chromatography : BMC |
19108846 | 20090130 | Analysis of quinocide in unprocessed primaquine diphosphate and primaquine diphosphate tablets using gas chromatography-mass spectrometry with supersonic molecular beams | Journal of chromatography. A |
Complexity: | 262 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 259.168462302 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 259.168462302 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 60.2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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