AG01EB1A

Name: MK-8998
Brand: Angene Chemical
SKU: AG01EB1A

953778-58-0 | MK-8998

AG01EB1A

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CAS Number	953778-58-0
Catalog Number	AG01EB1A
Chemical Name	MK-8998
IUPAC Name	2-(4-propan-2-ylphenyl)-N-[(1R)-1-[5-(2,2,2-trifluoroethoxy)pyridin-2-yl]ethyl]acetamide
InChI	InChI=1S/C20H23F3N2O2/c1-13(2)16-6-4-15(5-7-16)10-19(26)25-14(3)18-9-8-17(11-24-18)27-12-20(21,22)23/h4-9,11,13-14H,10,12H2,1-3H3,(H,25,26)/t14-/m1/s1
InChI Key	IQIKXZMPPBEWAD-CQSZACIVSA-N
MDL Number	MFCD22572346
Molecular Formula	C20H23F3N2O2
Molecular Weight	380.4040
SMILES	CC(C)C1=CC=C(C=C1)CC(=O)N[C@H](C)C1=NC=C(C=C1)OCC(F)(F)F
UNII	MIA4WMP8QN
Synonyms	MIA4WMP8QN, UNII-MIA4WMP8QN, Calcium channel inhibitor 1, MK-8998, CHEMBL1684950, 953778-58-0, MK-8998 free base, SCHEMBL1065999, IQIKXZMPPBEWAD-CQSZACIVSA-N, BCP18693, EX-A2479, BDBM50192668, MK8998, AKOS032945005, CS-6198, HY-101096, (R)-2-(4-isopropylphenyl)-N-(1-(5-(2,2,2-trifluoroethoxy)pyridin-2-yl)ethyl)acetamide, 2-(4-isopropylphenyl)-n-[(1r)-1-(5-(2,2,2-trifluoroethoxy)pyridin-2-yl)ethyl]acetamide, Benzeneacetamide, 4-(1-methylethyl)-N-((1R)-1-(5-(2,2,2-trifluoroethoxy)-2-pyridinyl)ethyl)-,

Complexity	463
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	380.171g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	380.411g/mol
Monoisotopic Mass	380.171g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	51.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.2

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