Vitas-M small molecule compound

dimethyl 4-(3-bromo-4,5-diethoxyphenyl)-1-cyclopropyl-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK403067
SMILES CCOc1cc(cc(c1OCC)Br)C1C(=CN(C=C1C(=O)OC)C1CC1)C(=O)OC

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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 C22H26BrNO6 MW 480.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26BrNO6/c1-5-29-18-10-13(9-17(23)20(18)30-6-2)19-15(21(25)27-3)11-24(14-7-8-14)12-16(19)22(26)28-4/h9-12,14,19H,5-8H2,1-4H3
InChIKey
OXNCDVSWSRUKJP-UHFFFAOYSA-N
Synonyms

CCOC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OC)C3CC3)C(=O)OC)Br)OCC
dimethyl4(3bromo45diethoxyphenyl)1cyclopropyl14dihydropyridine35dicarboxylate
DIMETHYL4(3BROMO45DIETHOXYPHENYL)1CYCLOPROPYL4HPYRIDINE35DICARBOXYLATE
InChI=1SC22H26BrNO6c1529181013(917(23)20(18)3062)1915(21(25)273)1124(147814)1216(19)22(26)284h9121419H58H214H3
MFCD03371069
ZINC000001438837
ZINC01438837
ZINC1438837

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Available files

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