Vitas-M small molecule compound

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

Catalog ID
STK011883
SMILES CCOC(=O)C1=CN(C=C(C1c1ccccc1OCC)C(=O)OCC)c1ccc(c(c1)C)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 C27H31NO5 MW 449.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31NO5/c1-6-31-24-12-10-9-11-21(24)25-22(26(29)32-7-2)16-28(17-23(25)27(30)33-8-3)20-14-13-18(4)19(5)15-20/h9-17,25H,6-8H2,1-5H3
InChIKey
NVSUTKNGHMUNQH-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CN(C=C(C1c1ccccc1OCC)C(=O)OCC)c1ccc(c(c1)C)C
CCOC1=CC=CC=C1C2C(=CN(C=C2C(=O)OCC)C3=CC(=C(C=C3)C)C)C(=O)OCC
DIETHYL1(34DIMETHYLPHENYL)4(2ETHOXYPHENYL)14DIHYDROPYRIDINE35DICARBOXYLATE
DIETHYL1(34DIMETHYLPHENYL)4(2ETHOXYPHENYL)4HPYRIDINE35DICARBOXYLATE
ETHYL1(34DIMETHYLPHENYL)5(ETHOXYCARBONYL)4(2ETHOXYPHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC27H31NO5c163124121091121(24)2522(26(29)3272)1628(1723(25)27(30)3383)20141318(4)19(5)1520h91725H68H215H3
MFCD02105297
STK011883
ZINC000002779899
ZINC02779899
ZINC2779899

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Available files

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