Vitas-M small molecule compound

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

Catalog ID
STL238157
SMILES COc1ccccc1NC(=O)C1CCN(CC1)c1ccc2n(n1)c(nn2)C(F)(F)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 C19H19F3N6O2 MW 420.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19F3N6O2/c1-30-14-5-3-2-4-13(14)23-17(29)12-8-10-27(11-9-12)16-7-6-15-24-25-18(19(20,21)22)28(15)26-16/h2-7,12H,8-11H2,1H3,(H,23,29)
InChIKey
WQRSTEFPFQCIFI-UHFFFAOYSA-N
Synonyms
949635-84-1
949635841
COC1=CC=CC=C1NC(=O)C2CCN(CC2)C3=NN4C(=NN=C4C(F)(F)F)C=C3
InChI=1SC19H19F3N6O2c13014532413(14)2317(29)1281027(11912)167615242518(19(2021)22)28(15)2616h2712H811H21H3(H2329)
MFCD10512126
N(2methoxyphenyl)1(3(trifluoromethyl)(124)triazolo(43b)pyridazin6yl)piperidine4carboxamide
ZINC000010507438
ZINC10507438

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Available files

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