AG01EOQU

Name: WEHI-539 hydrochloride
Brand: Angene Chemical
SKU: AG01EOQU

2070018-33-4 | WEHI-539 hydrochloride

AG01EOQU

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CAS Number	2070018-33-4
Catalog Number	AG01EOQU(AGN-PC-3H46HP)
Chemical Name	WEHI-539 hydrochloride
IUPAC Name	5-[3-[4-(aminomethyl)phenoxy]propyl]-2-[(8E)-8-(1,3-benzothiazol-2-ylhydrazinylidene)-6,7-dihydro-5H-naphthalen-2-yl]-1,3-thiazole-4-carboxylic acid;hydrochloride
InChI	InChI=1S/C31H29N5O3S2.ClH/c32-18-19-10-14-22(15-11-19)39-16-4-9-27-28(30(37)38)34-29(40-27)21-13-12-20-5-3-7-24(23(20)17-21)35-36-31-33-25-6-1-2-8-26(25)41-31;/h1-2,6,8,10-15,17H,3-5,7,9,16,18,32H2,(H,33,36)(H,37,38);1H/b35-24+;
InChI Key	GJBYTVIQTMIXGA-DYICZVFTSA-N
MDL Number	MFCD26960962
Molecular Formula	C31H30ClN5O3S2
Molecular Weight	620.1846
SMILES	C12CCC/C(=NNC3SC4C=CC=CC=4N=3)/C=1C=C(C1=NC(C(=O)O)=C(CCCOC3C=CC(CN)=CC=3)S1)C=C2.[H]Cl
Synonyms	WEHI-539 hydrochloride, 2070018-33-4, WEHI-539 (hydrochloride), HY-15607A, s7100, AKOS032944909, CS-1686, WEHI-539,

Complexity	903
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	619.148g/mol
Formal Charge	0
Heavy Atom Count	42
Hydrogen Bond Acceptor Count	10
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	620.183g/mol
Monoisotopic Mass	619.148g/mol
Rotatable Bond Count	10
Topological Polar Surface Area	179A^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