AG01EQF9

Name: NG25trihydrochloride
Brand: Angene Chemical
SKU: AG01EQF9

2108554-00-1 | NG25trihydrochloride

AG01EQF9

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CAS Number	2108554-00-1
Catalog Number	AG01EQF9(AGN-PC-3H479M)
Chemical Name	NG25trihydrochloride
IUPAC Name	N-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)benzamide;trihydrochloride
InChI	InChI=1S/C29H30F3N5O2.3ClH/c1-3-36-12-14-37(15-13-36)18-21-6-7-22(17-24(21)29(30,31)32)35-28(38)20-5-4-19(2)26(16-20)39-25-9-11-34-27-23(25)8-10-33-27;;;/h4-11,16-17H,3,12-15,18H2,1-2H3,(H,33,34)(H,35,38);3*1H
InChI Key	QOIOJVPRHIAONM-UHFFFAOYSA-N
MDL Number	MFCD28396417
Molecular Formula	C29H33Cl3F3N5O2
Molecular Weight	646.9588
SMILES	CCN1CCN(CC1)Cc1ccc(cc1C(F)(F)F)NC(=O)c1ccc(c(c1)Oc1ccnc2c1cc[nH]2)C.Cl.Cl.Cl
Synonyms	NG 25 trihydrochloride, 2108554-00-1, 3-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)-N-(4-((4-ethylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)-4-methylbenzamide trihydrochloride, 1315355-93-1,

Complexity	808
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	4
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	645.165g/mol
Formal Charge	0
Heavy Atom Count	42
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	5
Isotope Atom Count	0
Molecular Weight	646.961g/mol
Monoisotopic Mass	645.165g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	73.5A^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