AG000SFD

1262618-39-2 | 1,2,4-Triazolo[4,3-a]pyridine, 6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)-

AG000SFD

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CAS Number	1262618-39-2
Catalog Number	AG000SFD(AGN-PC-0WCYAX)
Chemical Name	1,2,4-Triazolo[4,3-a]pyridine, 6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)-
IUPAC Name	6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
InChI	InChI=1S/C14H7F6N3O/c15-13(16,17)12-22-21-11-6-3-9(7-23(11)12)8-1-4-10(5-2-8)24-14(18,19)20/h1-7H
InChI Key	FEVBKJITJDHASC-UHFFFAOYSA-N
MDL Number	MFCD28385879
Molecular Formula	C14H7F6N3O
Molecular Weight	347.2153
SMILES	FC(OC1=CC=C(C=C1)C=1C=CC=2N(C1)C(=NN2)C(F)(F)F)(F)F
Synonyms	6-(4-(trifluoromethoxy)phenyl)-3-(trifluoromethyl)(1,2,4)triazolo(4,3-a)pyridine, GS-458967, GS-967, GS967, GS967, 1262618-39-2, GS-967, 6-(4-(trifluoromethoxy)phenyl)-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine, CHEMBL3809595, AK204881, GS-458967, 6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine, 6-(4-Trifluoromethoxy-phenyl)-3-trifluoromethyl-[1,2,4]triazolo[4,3-a]pyridine, FEVBKJITJDHASC-UHFFFAOYSA-N, SCHEMBL937066, GTPL9858, EX-A652, AOB87332, BCP14893, KS-00001CZ3, BDBM50173134, MFCD28385879, AKOS026750327, ZINC114879021, CS-3791, NCGC00408812-01, AS-35319, BC600694, GS458967, HY-12593, GS967(GS-458967), B5850, FT-0700151, J3.583.990I, A14361, J-690112, (6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine), 1,2,4-Triazolo[4,3-a]pyridine, 6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)-, 4'-((2-Butyl-6-(((cyclohexylamino)carbonyl)amino)-1H-benzimidazo-1-yl)methyl)-(1,1'-biphenyl)-2-carboxylic acid,

Complexity	435
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	347.049g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	347.22g/mol
Monoisotopic Mass	347.049g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	39.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H320-H335
Packing Group	\N
Precautionary statements	P264-P270-P301+P312-P330
UN Code	\N

Certificate of Analysis

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