Vitas-M small molecule compound

N-(5-chloro-2-methoxyphenyl)-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-4-carboxamide

Catalog ID
STK643232
SMILES COc1ccc(cc1NC(=O)C1CCN(CC1)c1ccc2n(n1)c(C)nn2)Cl

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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 C19H21ClN6O2 MW 400.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN6O2/c1-12-22-23-17-5-6-18(24-26(12)17)25-9-7-13(8-10-25)19(27)21-15-11-14(20)3-4-16(15)28-2/h3-6,11,13H,7-10H2,1-2H3,(H,21,27)
InChIKey
KETUCRBPEDMLDV-UHFFFAOYSA-N
Synonyms
1081131-58-9
1081131589
CC1=NN=C2N1N=C(C=C2)N3CCC(CC3)C(=O)NC4=C(C=CC(=C4)Cl)OC
InChI=1SC19H21ClN6O2c1122223175618(2426(12)17)259713(81025)19(27)21151114(20)3416(15)282h361113H710H212H3(H2127)
MFCD12210349
N(5chloro2methoxyphenyl)1(3methyl(124)triazolo(43b)pyridazin6yl)piperidine4carboxamide
ZINC000020745509
ZINC20745509

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Available files

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