Vitas-M small molecule compound

di-tert-butyl 2',6'-dimethyl-1',4'-dihydro-3,4'-bipyridine-3',5'-dicarboxylate

Catalog ID
STK516056
SMILES CC1=C(C(=O)OC(C)(C)C)C(C(=C(N1)C)C(=O)OC(C)(C)C)c1cccnc1

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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 C22H30N2O4 MW 386.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N2O4/c1-13-16(19(25)27-21(3,4)5)18(15-10-9-11-23-12-15)17(14(2)24-13)20(26)28-22(6,7)8/h9-12,18,24H,1-8H3
InChIKey
GEUNEJZDBNZVHD-UHFFFAOYSA-N
Synonyms
80592-76-3
80592763
CC1=C(C(C(=C(N1)C)C(=O)OC(C)(C)C)C2=CN=CC=C2)C(=O)OC(C)(C)C
ditertbutyl26dimethyl14dihydro34bipyridine35dicarboxylate
DITERTBUTYL26DIMETHYL4PYRIDIN3YL14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC22H30N2O4c11316(19(25)2721(34)5)18(1510911231215)17(14(2)2413)20(26)2822(67)8h9121824H18H3
MFCD01882050
ZINC000024334636
ZINC24334636

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Available files

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