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2-Naphthalenecarboxylic acid, 4,4'-methylenebis(3-hydroxy-, compd. with N1,N1-diethyl-N4-(6-methoxy-8-quinolinyl)-1,4-pentanediamine (1:1)

HCID 12474
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
635-05-2
Standard SMILES
CCN(CC)CCCC(C)Nc1cc(OC)cc2cccnc12.O=C(O)c1cc2ccccc2c(Cc2c(O)c(C(=O)O)cc3ccccc23)c1O
InChIKey
IPPMKVWUPMOGFL-UHFFFAOYSA-N
Molecular formula
C42H45N3O7
Average molar mass
703.8 g/mol
Monoisotopic mass
703.32575078

Names & identifiers

Preferred name
2-Naphthalenecarboxylic acid, 4,4'-methylenebis(3-hydroxy-, compd. with N1,N1-diethyl-N4-(6-methoxy-8-quinolinyl)-1,4-pentanediamine (1:1)
IUPAC
4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine
English name
pamaquine
Molecular formula
C42H45N3O7
Molecular weight
703.8226

Names & synonyms

Pamaquine naphthoatePamaquine embonatePamaquine pamoate635-05-2Aminoquin naphthoatePamachinaPamaquinaPamaquinum96Y4A9AODBNSC-14220DTXSID901021385RefChem:1063885
Show more names
PamoatepamaquinePlasmoquinePAMAQUINEEMBONATEpamaquine USP/EP/BPdiethyl-[4-[(6-methoxy-8-quinolyl)amino]pentyl]amineN1,N1-diethyl-N4-(6-methoxyquinolin-8-yl)pentane-1,4-diamine1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine4-[(3-carboxy-2-hydroxy-1-naphthyl)methyl]-3-hydroxy-2-naphthoic acid
DTXCID301506430211-224-5Gamefar naphthoateQuipenyl naphthoatePraequine naphthoateBeprochine naphthoatePlasmochin naphthoatePlasmoquine naphthoate

Database identifiers

CAS
635-05-2

Properties

Computed structural properties

Topological polar surface area
152 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
10
Rotatable bonds
13
Heavy atoms
52
Formal charge
0
Complexity
890

Physicochemical properties

FDA UNII
96 Y4A9AODB · 96Y4A9AODB

Chemistry & industry

Suppliers1 total

Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
PubChem CID
12474
DTXSID
DTXSID901021385
ChEMBL
CHEMBL3989863
UNII
96Y4A9AODB