Vitas-M small molecule compound

dimethyl 4-(4-ethoxyphenyl)-1-(tetrahydrofuran-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK030692
SMILES CCOc1ccc(cc1)C1C(=CN(C=C1C(=O)OC)CC1CCCO1)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 C22H27NO6 MW 401.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO6/c1-4-28-16-9-7-15(8-10-16)20-18(21(24)26-2)13-23(12-17-6-5-11-29-17)14-19(20)22(25)27-3/h7-10,13-14,17,20H,4-6,11-12H2,1-3H3
InChIKey
PMZYTSAEVDDFFM-UHFFFAOYSA-N
Synonyms

CCOC1=CC=C(C=C1)C2C(=CN(C=C2C(=O)OC)CC3CCCO3)C(=O)OC
CCOc1ccc(cc1)C1C(=CN(C=C1C(=O)OC)CC1CCCO1)C(=O)OC
DIMETHYL4(4ETHOXYPHENYL)1((2R)TETRAHYDROFURAN2YLMETHYL)14DIHYDROPYRIDINE35DICARBOXYLATE
DIMETHYL4(4ETHOXYPHENYL)1((2S)TETRAHYDROFURAN2YLMETHYL)14DIHYDROPYRIDINE35DICARBOXYLATE
DIMETHYL4(4ETHOXYPHENYL)1(OXOLAN2YLMETHYL)4HPYRIDINE35DICARBOXYLATE
DIMETHYL4(4ETHOXYPHENYL)1(TETRAHYDROFURAN2YLMETHYL)14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC22H27NO6c1428169715(81016)2018(21(24)262)1323(121765112917)1419(20)22(25)273h71013141720H461112H213H3
METHYL4(4ETHOXYPHENYL)5(METHOXYCARBONYL)1(OXOLAN2YLMETHYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD02627371
STK030692
ZINC000001087835
ZINC000001087836

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Available files

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