Vitas-M small molecule compound

dimethyl 4-(3-bromophenyl)-1-(2-methylpropyl)-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK405273
SMILES COC(=O)C1=CN(CC(C)C)C=C(C1c1cccc(c1)Br)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 C19H22BrNO4 MW 408.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22BrNO4/c1-12(2)9-21-10-15(18(22)24-3)17(16(11-21)19(23)25-4)13-6-5-7-14(20)8-13/h5-8,10-12,17H,9H2,1-4H3
InChIKey
XBHRXARXFRIRSM-UHFFFAOYSA-N
Synonyms

CC(C)CN1C=C(C(C(=C1)C(=O)OC)C2=CC(=CC=C2)Br)C(=O)OC
dimethyl4(3bromophenyl)1(2methylpropyl)14dihydropyridine35dicarboxylate
DIMETHYL4(3BROMOPHENYL)1(2METHYLPROPYL)4HPYRIDINE35DICARBOXYLATE
InChI=1SC19H22BrNO4c112(2)9211015(18(22)243)17(16(1121)19(23)254)1365714(20)813h58101217H9H214H3
METHYL4(3BROMOPHENYL)5(METHOXYCARBONYL)1(2METHYLPROPYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD03999016
ZINC000001140618
ZINC01140618
ZINC1140618

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Available files

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