AG00C6K8

Name: Velneperit
Brand: Angene Chemical
SKU: AG00C6K8

342577-38-2 | Velneperit

AG00C6K8

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CAS Number	342577-38-2
Catalog Number	AG00C6K8(AGN-PC-0R9M7W)
Chemical Name	Velneperit
IUPAC Name	4-(tert-butylsulfonylamino)-N-[5-(trifluoromethyl)pyridin-2-yl]cyclohexane-1-carboxamide
InChI	InChI=1S/C17H24F3N3O3S/c1-16(2,3)27(25,26)23-13-7-4-11(5-8-13)15(24)22-14-9-6-12(10-21-14)17(18,19)20/h6,9-11,13,23H,4-5,7-8H2,1-3H3,(H,21,22,24)
InChI Key	WGEWUYACXPEFPO-UHFFFAOYSA-N
MDL Number	MFCD11973642
Molecular Formula	C17H24F3N3O3S
Molecular Weight	407.4510
SMILES	O=C([C@H]1CC[C@H](NS(=O)(C(C)(C)C)=O)CC1)NC2=NC=C(C(F)(F)F)C=C2
UNII	09BQ2KJ22J
Synonyms	Velneperit, 342577-38-2, S-2367, UNII-09BQ2KJ22J, 09BQ2KJ22J, Velneperit [USAN:INN], Velneperit (USAN/INN), SCHEMBL2806595, CHEMBL2016681, SCHEMBL10114559, SCHEMBL10134095, SCHEMBL13204979, BCP16623, BDBM50380914, ZINC257354192, CS-5388, DB12889, BC282913, HY-14423, D08026, 577V382, S-2367;S2367;S 2367, Cyclohexanecarboxamide, 4-(((1,1-dimethylethyl)sulfonyl)amino)-N-(5-(trifluoromethyl)-2-pyridinyl)-, trans-, trans-4-(((1,1-Dimethylethyl)sulfonyl)amino)-N-(5-(trifluoromethyl)pyridin-2-yl)cyclohexanecarboxamide, Velneperit [USAN], D0K4NZ,

Complexity	618
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	407.149g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	407.452g/mol
Monoisotopic Mass	407.149g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	96.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

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