AG008ZG5

Name: Sitamaquine (tosylate)
Brand: Angene Chemical
SKU: AG008ZG5

1019640-33-5 | Sitamaquine (tosylate)

AG008ZG5

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CAS Number	1019640-33-5
Catalog Number	AG008ZG5
Chemical Name	Sitamaquine (tosylate)
IUPAC Name	N',N'-diethyl-N-(6-methoxy-4-methylquinolin-8-yl)hexane-1,6-diamine;4-methylbenzenesulfonic acid
InChI	InChI=1S/C21H33N3O.C7H8O3S/c1-5-24(6-2)14-10-8-7-9-12-22-20-16-18(25-4)15-19-17(3)11-13-23-21(19)20;1-6-2-4-7(5-3-6)11(8,9)10/h11,13,15-16,22H,5-10,12,14H2,1-4H3;2-5H,1H3,(H,8,9,10)
InChI Key	LOBPWLFCZDGYKW-UHFFFAOYSA-N
MDL Number	MFCD17392572
Molecular Formula	C28H41N3O4S
Molecular Weight	515.7078
SMILES	O=S(O)(C1=CC=C(C)C=C1)=O.COC2=CC3=C(C)C=CN=C3C(NCCCCCCN(CC)CC)=C2
Synonyms	Sitamaquine tosylate, WR 6026 tosylate, SCHEMBL2933465, Sitamaquine tosylate, >=98% (HPLC), 1019640-33-5, N,N-Diethyl-N'-(6-methoxy-4-methyl-quinolin-8-yl)-hexane-1,6-diamine tosylate, 57695-04-2, N1,N1-Diethyl-N6-(6-methoxy-4-methyl-8-quinolinyl)-1,6-hexanediamine 4-methylbenzenesulfonate,

Complexity	554
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	515.282g/mol
Formal Charge	0
Heavy Atom Count	36
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	515.713g/mol
Monoisotopic Mass	515.282g/mol
Rotatable Bond Count	12
Topological Polar Surface Area	100A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited