Vitas-M small molecule compound

tetraethyl 4,4'-benzene-1,4-diylbis(2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate)

Catalog ID
STK358758
SMILES CCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)C1C(=C(C)NC(=C1C(=O)OCC)C)C(=O)OCC)C(=O)OCC)C

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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 C32H40N2O8 MW 580.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H40N2O8/c1-9-39-29(35)23-17(5)33-18(6)24(30(36)40-10-2)27(23)21-13-15-22(16-14-21)28-25(31(37)41-11-3)19(7)34-20(8)26(28)32(38)42-12-4/h13-16,27-28,33-34H,9-12H2,1-8H3
InChIKey
QBANWHHXDDLFNZ-UHFFFAOYSA-N
Synonyms
115951-98-9
115951989
44PPHENYLENEBIS(26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLICACIDDIETHYL)ESTER
CCOC(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)C3C(=C(NC(=C3C(=O)OCC)C)C)C(=O)OCC)C(=O)OCC)C)C
DIETHYL4(4(35BIS(ETHOXYCARBONYL)26DIMETHYL14DIHYDROPYRIDIN4YL)PHENYL)26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE
ETHYL4(4(35BIS(ETHOXYCARBONYL)26DIMETHYL(414DIHYDROPYRIDYL))PHENYL)5(ETHOXYCARBONYL)26DIMETHYL14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC32H40N2O8c193929(35)2317(5)3318(6)24(30(36)40102)27(23)21131522(161421)2825(31(37)41113)19(7)3420(8)26(28)32(38)42124h131627283334H912H218H3
MFCD00474179
TETRAETHYL44(14PHENYLENE)BIS(26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE)
TETRAETHYL44BENZENE14DIYLBIS(26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE)
ZINC000029747408
ZINC29747408

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Available files

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