Vitas-M small molecule compound

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

Catalog ID
STK932932
SMILES O=C(C1CCCN(C1)c1ccc2n(n1)c(nn2)C(F)(F)F)NCc1cccnc1

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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 C18H18F3N7O MW 405.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18F3N7O/c19-18(20,21)17-25-24-14-5-6-15(26-28(14)17)27-8-2-4-13(11-27)16(29)23-10-12-3-1-7-22-9-12/h1,3,5-7,9,13H,2,4,8,10-11H2,(H,23,29)
InChIKey
MEWRRHVCTBLBBE-UHFFFAOYSA-N
Synonyms
1219578-33-2
1219578332
C1CC(CN(C1)C2=NN3C(=NN=C3C(F)(F)F)C=C2)C(=O)NCC4=CN=CC=C4
InChI=1SC18H18F3N7Oc1918(2021)172524145615(2628(14)17)2782413(1127)16(29)23101231722912h1357913H2481011H2(H2329)
MFCD16623417
N(pyridin3ylmethyl)1(3(trifluoromethyl)(124)triazolo(43b)pyridazin6yl)piperidine3carboxamide
ZINC000040266847
ZINC000040266848

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Available files

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