AG00FDUF

Name: O6-[4-(Trifluoroacetamidomethyl)benzyl]guanine
Brand: Angene Chemical
SKU: AG00FDUF

680622-70-2 | O6-[4-(Trifluoroacetamidomethyl)benzyl]guanine

AG00FDUF

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CAS Number	680622-70-2
Catalog Number	AG00FDUF(AGN-PC-0TR245)
Chemical Name	O6-[4-(Trifluoroacetamidomethyl)benzyl]guanine
IUPAC Name	N-[[4-[(2-amino-7H-purin-6-yl)oxymethyl]phenyl]methyl]-2,2,2-trifluoroacetamide
InChI	InChI=1S/C15H13F3N6O2/c16-15(17,18)13(25)20-5-8-1-3-9(4-2-8)6-26-12-10-11(22-7-21-10)23-14(19)24-12/h1-4,7H,5-6H2,(H,20,25)(H3,19,21,22,23,24)
InChI Key	AQFWAWXGBQPBIA-UHFFFAOYSA-N
MDL Number	MFCD09841373
Molecular Formula	C15H13F3N6O2
Molecular Weight	366.2979
SMILES	C(NCC1=CC=C(COC2=C3C(=NC(N)=N2)N=CN3)C=C1)(=O)C(F)(F)F
Synonyms	O6-[4-(Trifluoroacetamidomethyl)benzyl]guanine, 680622-70-2, SCHEMBL2775958, CTK8E9788, DTXSID40652683, ZINC22067240, AKOS030242660, RT-014833, FT-0675485, N-[4-(2-Amino-9H-purin-6-yloxymethyl)-benzyl]-2,2,2-trifluoroacetamide, N-[(4-{[(2-Amino-7H-purin-6-yl)oxy]methyl}phenyl)methyl]-2,2,2-trifluoroacetamide, api-1, AQFWAWXGBQPBIA-UHFFFAOYSA-N,

Complexity	487
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	366.105g/mol
Formal Charge	0
Heavy Atom Count	26
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	366.304g/mol
Monoisotopic Mass	366.105g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	119A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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