Vitas-M small molecule compound

diethyl 1-(2,5-dimethylphenyl)-4-(4-ethoxy-3-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK091494
SMILES CCOC(=O)C1=CN(C=C(C1c1ccc(c(c1)OC)OCC)C(=O)OCC)c1cc(C)ccc1C

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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 C28H33NO6 MW 479.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33NO6/c1-7-33-24-13-12-20(15-25(24)32-6)26-21(27(30)34-8-2)16-29(17-22(26)28(31)35-9-3)23-14-18(4)10-11-19(23)5/h10-17,26H,7-9H2,1-6H3
InChIKey
CDMXVPRJKURXLD-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CN(C=C(C1c1ccc(c(c1)OC)OCC)C(=O)OCC)c1cc(C)ccc1C
CCOC1=C(C=C(C=C1)C2C(=CN(C=C2C(=O)OCC)C3=C(C=CC(=C3)C)C)C(=O)OCC)OC
DIETHYL1(25DIMETHYLPHENYL)4(4ETHOXY3METHOXYPHENYL)14DIHYDRO35PYRIDINEDICARBOXYLATE
DIETHYL1(25DIMETHYLPHENYL)4(4ETHOXY3METHOXYPHENYL)14DIHYDROPYRIDINE35DICARBOXYLATE
DIETHYL1(25DIMETHYLPHENYL)4(4ETHOXY3METHOXYPHENYL)4HPYRIDINE35DICARBOXYLATE
ETHYL1(25DIMETHYLPHENYL)5(ETHOXYCARBONYL)4(4ETHOXY3METHOXYPHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC28H33NO6c173324131220(1525(24)326)2621(27(30)3482)1629(1722(26)28(31)3593)231418(4)101119(23)5h101726H79H216H3
MFCD02188810
STK091494
ZINC000000717240
ZINC00717240
ZINC717240

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Available files

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