Vitas-M small molecule compound

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

Catalog ID
STK404137
SMILES CCOc1cc(cc(c1OCC)Br)C1C(=CN(C=C1C(=O)OC)Cc1ccc(c(c1)OC)OC)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 C28H32BrNO8 MW 590.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32BrNO8/c1-7-37-24-13-18(12-21(29)26(24)38-8-2)25-19(27(31)35-5)15-30(16-20(25)28(32)36-6)14-17-9-10-22(33-3)23(11-17)34-4/h9-13,15-16,25H,7-8,14H2,1-6H3
InChIKey
FREVJBSQOKJMEN-UHFFFAOYSA-N
Synonyms

CCOC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OC)CC3=CC(=C(C=C3)OC)OC)C(=O)OC)Br)OCC
DIMETHYL4(3BROMO45DIETHOXYPHENYL)1((34DIMETHOXYPHENYL)METHYL)4HPYRIDINE35DICARBOXYLATE
dimethyl4(3bromo45diethoxyphenyl)1(34dimethoxybenzyl)14dihydropyridine35dicarboxylate
InChI=1SC28H32BrNO8c1737241318(1221(29)26(24)3882)2519(27(31)355)1530(1620(25)28(32)366)141791022(333)23(1117)344h913151625H7814H216H3
METHYL1((34DIMETHOXYPHENYL)METHYL)4(3BROMO45DIETHOXYPHENYL)5(METHOXYCARBONYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD04056956
ZINC000097939646
ZINC97939646

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Available files

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