AG01EOKF

Name: BAY-2402234
Brand: Angene Chemical
SKU: AG01EOKF

2225819-06-5 | BAY-2402234

AG01EOKF

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CAS Number	2225819-06-5
Catalog Number	AG01EOKF(AGN-PC-3H46EN)
Chemical Name	BAY-2402234
IUPAC Name	N-(2-chloro-6-fluorophenyl)-4-[4-ethyl-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-5-fluoro-2-[(2S)-1,1,1-trifluoropropan-2-yl]oxybenzamide
InChI	InChI=1S/C21H18ClF5N4O4/c1-3-30-17(9-32)29-31(20(30)34)15-8-16(35-10(2)21(25,26)27)11(7-14(15)24)19(33)28-18-12(22)5-4-6-13(18)23/h4-8,10,32H,3,9H2,1-2H3,(H,28,33)/t10-/m0/s1
InChI Key	KNVJMHHAXCPZHF-JTQLQIEISA-N
MDL Number	MFCD31692414
Molecular Formula	C21H18ClF5N4O4
Molecular Weight	520.8370
SMILES	O=c1n(nc(n1CC)CO)c1cc(O[C@H](C(F)(F)F)C)c(cc1F)C(=O)Nc1c(Cl)cccc1F
Synonyms	BAY-2402234, SCHEMBL20108031, HY-112645, CS-0058850, 2225819-06-5,

Complexity	819
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	520.094g/mol
Formal Charge	0
Heavy Atom Count	35
Hydrogen Bond Acceptor Count	10
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	520.841g/mol
Monoisotopic Mass	520.094g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	94.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4

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