Vitas-M small molecule compound

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

Catalog ID
STK653126
SMILES O=C(C1CCCN(C1)c1ccc2n(n1)c(nn2)C(F)(F)F)Nc1ccc(cc1)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 C18H16F4N6O MW 408.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16F4N6O/c19-12-3-5-13(6-4-12)23-16(29)11-2-1-9-27(10-11)15-8-7-14-24-25-17(18(20,21)22)28(14)26-15/h3-8,11H,1-2,9-10H2,(H,23,29)
InChIKey
GWROOIUSEFDIKL-UHFFFAOYSA-N
Synonyms
1144444-79-0
1144444790
C1CC(CN(C1)C2=NN3C(=NN=C3C(F)(F)F)C=C2)C(=O)NC4=CC=C(C=C4)F
InChI=1SC18H16F4N6Oc19123513(6412)2316(29)1121927(1011)158714242517(18(2021)22)28(14)2615h3811H12910H2(H2329)
MFCD12216606
N(4fluorophenyl)1(3(trifluoromethyl)(124)triazolo(43b)pyridazin6yl)piperidine3carboxamide
ZINC000032101516
ZINC000032101518

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Available files

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