Pamaquine - CAS 491-92-9
Catalog: |
BB026653 |
Product Name: |
Pamaquine |
CAS: |
491-92-9 |
Synonyms: |
Pamaquin |
Related CAS: | 635-05-2 (naphthoate) 63680-62-6 (hydrochloride)
|
IUPAC Name: | 1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine |
Description: | Pamaquine is a synthetic 8-aminoquinoline drug used for the treatment of malaria. |
Molecular Weight: | 315.5 |
Molecular Formula: | C19H29N3O |
Canonical SMILES: | CCN(CC)CCCC(C)NC1=C2C(=CC(=C1)OC)C=CC=N2 |
InChI: | InChI=1S/C19H29N3O/c1-5-22(6-2)12-8-9-15(3)21-18-14-17(23-4)13-16-10-7-11-20-19(16)18/h7,10-11,13-15,21H,5-6,8-9,12H2,1-4H3 |
InChI Key: | QTQWMSOQOSJFBV-UHFFFAOYSA-N |
LogP: | 4.23880 |
Publication Number | Title | Priority Date |
CN-111955469-A | Pesticide for cucumbers and cucumber pest control method | 20200828 |
JP-2020203897-A | Oxime-substituted amide compounds and pest control agents | 20200812 |
JP-2020186245-A | Oxime-substituted amide compounds and pest control agents | 20200716 |
WO-2021211923-A1 | Compositions and methods for treating disease | 20200416 |
WO-2021204717-A1 | Aminoquinolines for treating coronavirus infections | 20200406 |
PMID | Publication Date | Title | Journal |
24206914 | 20131111 | Identification of inhibitors of Plasmodium falciparum gametocyte development | Malaria journal |
22006241 | 20120301 | Real-time 2D separation by LC × differential ion mobility hyphenated to mass spectrometry | Analytical and bioanalytical chemistry |
22360483 | 20120101 | Current advances in detection and treatment of babesiosis | Current medicinal chemistry |
21989376 | 20111011 | Determinants of relapse periodicity in Plasmodium vivax malaria | Malaria journal |
21933377 | 20110920 | Discovery of potent, novel, non-toxic anti-malarial compounds via quantum modelling, virtual screening and in vitro experimental validation | Malaria journal |
Complexity: | 322 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 315.231062557 |
Formal Charge: | 0 |
Heavy Atom Count: | 23 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 315.231062557 |
Rotatable Bond Count: | 9 |
Topological Polar Surface Area: | 37.4 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.1 |
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Related Functional Groups
Quinoline/Isoquinoline
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