Vitas-M small molecule compound

methyl 6-(3-bromophenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylate

Catalog ID
STK314280
SMILES COC(=O)c1cc(nc2c1c(C)nn2c1ccccc1)c1cccc(c1)Br

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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 C21H16BrN3O2 MW 422.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrN3O2/c1-13-19-17(21(26)27-2)12-18(14-7-6-8-15(22)11-14)23-20(19)25(24-13)16-9-4-3-5-10-16/h3-12H,1-2H3
InChIKey
QENAWXPBGOQGEV-UHFFFAOYSA-N
Synonyms
832745-98-9
832745989
CC1=NN(C2=C1C(=CC(=N2)C3=CC(=CC=C3)Br)C(=O)OC)C4=CC=CC=C4
InChI=1SC21H16BrN3O2c1131917(21(26)272)1218(1476815(22)1114)2320(19)25(2413)1694351016h312H12H3
methyl6(3bromophenyl)3methyl1phenyl1Hpyrazolo(34b)pyridine4carboxylate
methyl6(3bromophenyl)3methyl1phenylpyrazolo(34b)pyridine4carboxylate
MFCD05667621
ZINC000002733630
ZINC02733630
ZINC2733630

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Available files

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