Vitas-M small molecule compound

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

Catalog ID
STK403955
SMILES COC(=O)C1=CN(Cc2ccc(cc2)OC)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 C23H22BrNO5 MW 472.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrNO5/c1-28-18-9-7-15(8-10-18)12-25-13-19(22(26)29-2)21(20(14-25)23(27)30-3)16-5-4-6-17(24)11-16/h4-11,13-14,21H,12H2,1-3H3
InChIKey
KQMPUUAGPMCXPU-UHFFFAOYSA-N
Synonyms

COC1=CC=C(C=C1)CN2C=C(C(C(=C2)C(=O)OC)C3=CC(=CC=C3)Br)C(=O)OC
DIMETHYL4(3BROMOPHENYL)1((4METHOXYPHENYL)METHYL)4HPYRIDINE35DICARBOXYLATE
dimethyl4(3bromophenyl)1(4methoxybenzyl)14dihydropyridine35dicarboxylate
InChI=1SC23H22BrNO5c128189715(81018)12251319(22(26)292)21(20(1425)23(27)303)1654617(24)1116h411131421H12H213H3
METHYL4(3BROMOPHENYL)5(METHOXYCARBONYL)1((4METHOXYPHENYL)METHYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD03632721
ZINC000002797087
ZINC02797087
ZINC2797087

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Available files

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