Basic information
- CAS
316-05-2- Standard SMILES
CCN(CC)CCCC(C)Nc1c2cc(Cl)ccc2nc2ccc(OC)cc12.CS(=O)(=O)O.CS(=O)(=O)O- InChIKey
WWVNAZRWEIACFQ-UHFFFAOYSA-N- Molecular formula
- C25H38ClN3O7S2
- Average molar mass
- 592.2 g/mol
- Monoisotopic mass
- 591.1839706
Names & identifiers
- Preferred name
- Methanesulfonic acid--4-[(2-chloro-7-methoxyacridin-9(10H)-ylidene)amino]-N,N-diethylpentan-1-amine (2/1)
- IUPAC
- 4-N-(2-chloro-7-methoxyacridin-9-yl)-1-N,1-N-diethylpentane-1,4-diamine;methanesulfonic acid
- English name
- mepacrine mesilate
- Molecular formula
- C24H34ClN3O4S
- Molecular weight
- 496.06
Names & synonyms
DTXSID40953561NS00125452Methanesulfonic acid--4-[(2-chloro-7-methoxyacridin-9(10H)-ylidene)amino]-N,N-diethylpentan-1-amine (2/1)MusonalEinecs 206-256-1mepacrine mesilatequinacrine mesylateMepacrine methanesulfonateQuinacrine methanesulfonateMepacrine dimethanesulfonate salt1,4-Pentanediamine, N4-(6-chloro-2-methoxy-9-acridinyl)-N1,N1-diethyl-, dimethanesulfonateAcridine, 6-chloro-9-((4-(diethylamino)-1-methylbutyl)amino)-2-methoxy-, dimethanesulfonate
Database identifiers
- CAS
316-05-2- PubChem CID
- 9420
- DTXSID
DTXSID40953561
Properties
Computed structural properties
- Topological polar surface area
- 163 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 9
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 554
Physicochemical properties
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 6 I25JPB · XDY6I25JPB
Chemistry & industry
Applications
UsesQuinacrine (Mepacrine) methanesulfonate is a potent, orally active antimalarial agent with antitumor effects in vitro and in vivo. Quinacrine dihydrochloride inhibits NF-κB and activates p53 signaling, inducing apoptosis in tumor cells[1][2].
Suppliers3 total
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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