AG003AC8

1352608-82-2 | N-[[4-([1,2,4]Triazolo[1,5-a]pyridin-6-yl)-5-(6-methylpyridin-2-yl)-1H-imidazol-2-yl]methyl]-2-fluoroaniline

AG003AC8

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CAS Number	1352608-82-2
Catalog Number	AG003AC8(AGN-PC-0WALT4)
Chemical Name	N-[[4-([1,2,4]Triazolo[1,5-a]pyridin-6-yl)-5-(6-methylpyridin-2-yl)-1H-imidazol-2-yl]methyl]-2-fluoroaniline
IUPAC Name	2-fluoro-N-[[5-(6-methylpyridin-2-yl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]aniline
InChI	InChI=1S/C22H18FN7/c1-14-5-4-8-18(27-14)22-21(15-9-10-20-25-13-26-30(20)12-15)28-19(29-22)11-24-17-7-3-2-6-16(17)23/h2-10,12-13,24H,11H2,1H3,(H,28,29)
InChI Key	FJCDSQATIJKQKA-UHFFFAOYSA-N
MDL Number	MFCD28348363
Molecular Formula	C22H18FN7
Molecular Weight	399.4236
SMILES	FC1=C(C=CC=C1)NCC=1NC(=C(N1)C=1C=CC=2N(C1)N=CN2)C2=NC(=CC=C2)C
UNII	6T4O391P5Y
Synonyms	EW-7197, N-((4-((1,2,4)triazolo(1,5-a)pyridin-6-yl)-5-(6-methylpyridin-2-yl)-1H-imidazol-2-yl)methyl)-2-fluoroaniline, 1352608-82-2, EW-7197, vactosertib, EW 7197, TEW-7197, CHEMBL3260567, N-[[4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-5-(6-methylpyridin-2-yl)-1h-imidazol-2-yl]methyl]-2-fluoroaniline, N-(2-Fluorophenyl)-5-(6-methyl-2-pyridinyl)-4-[1,2,4]triazolo-[1,5-a]pyridin-6-yl-1H-imidazole-2-methanamine, N-(2-fluorophenyl)-5-(6-methyl-2-pyridinyl)-4-[1,2,4]triazolo[1,5-a]pyridin-6-yl-1H-imidazole-2-methanamine, SCHEMBL250076, UNII-6T4O391P5Y, Vactosertib (TEW-7197), GTPL8107, C22H18FN7, KS-00001DHW, 6T4O391P5Y, BCP18384, EX-A1738, NOV-1301, 2408AH, BDBM50015639, s7530, AKOS027250746, ZINC113391423, CS-5679, SB17272, NCGC00386413-01, AC-29028, AK175563, AS-10150, HY-19928, SC-82436, B5946, A14213, 2-fluoro-N-[[5-(6-methylpyridin-2-yl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]aniline, N-(2-Fluorophenyl)-4-([1,2,4]triazolo[1,5-a]pyridine-6-yl)-5-(6-methyl-2-pyridyl)-1H-imidazole-2-methaneamine, TEW 7197, EW7197, ACN-037521,

Complexity	566
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	399.161g/mol
Formal Charge	0
Heavy Atom Count	30
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	399.433g/mol
Monoisotopic Mass	399.161g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	83.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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