Vitas-M small molecule compound

N-(3-chloro-4-fluorophenyl)-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-3-carboxamide

Catalog ID
STK653959
SMILES O=C(C1CCCN(C1)c1ccc2n(n1)c(nn2)C(F)(F)F)Nc1ccc(c(c1)Cl)F

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C18H15ClF4N6O MW 442.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClF4N6O/c19-12-8-11(3-4-13(12)20)24-16(30)10-2-1-7-28(9-10)15-6-5-14-25-26-17(18(21,22)23)29(14)27-15/h3-6,8,10H,1-2,7,9H2,(H,24,30)
InChIKey
ZEVXFWFSLXSRGJ-UHFFFAOYSA-N
Synonyms
1144469-23-7
1144469237
C1CC(CN(C1)C2=NN3C(=NN=C3C(F)(F)F)C=C2)C(=O)NC4=CC(=C(C=C4)F)Cl
InChI=1SC18H15ClF4N6Oc1912811(3413(12)20)2416(30)1021728(910)156514252617(18(2122)23)29(14)2715h36810H1279H2(H2430)
MFCD12215002
N(3chloro4fluorophenyl)1(3(trifluoromethyl)(124)triazolo(43b)pyridazin6yl)piperidine3carboxamide
ZINC000032094811
ZINC000032094813

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.