Vitas-M small molecule compound

dimethyl 4-(1,3-benzodioxol-5-yl)-1-(2-phenylethyl)-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK022403
SMILES COC(=O)C1=CN(CCc2ccccc2)C=C(C1c1ccc2c(c1)OCO2)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 C24H23NO6 MW 421.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23NO6/c1-28-23(26)18-13-25(11-10-16-6-4-3-5-7-16)14-19(24(27)29-2)22(18)17-8-9-20-21(12-17)31-15-30-20/h3-9,12-14,22H,10-11,15H2,1-2H3
InChIKey
BCELABWBYQVXNF-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CN(C=C(C1C2=CC3=C(C=C2)OCO3)C(=O)OC)CCC4=CC=CC=C4
COC(=O)C1=CN(CCc2ccccc2)C=C(C1c1ccc2c(c1)OCO2)C(=O)OC
DIMETHYL4(13BENZODIOXOL5YL)1(2PHENYLETHYL)14DIHYDROPYRIDINE35DICARBOXYLATE
dimethyl4(13benzodioxol5yl)1(2phenylethyl)4Hpyridine35dicarboxylate
DIMETHYL4(13BENZODIOXOL5YL)1PHENETHYL4HPYRIDINE35DICARBOXYLATE
InChI=1SC24H23NO6c12823(26)181325(1110166435716)1419(24(27)292)22(18)17892021(1217)31153020h39121422H101115H212H3
METHYL4(2HBENZO(34D)13DIOXOLEN5YL)5(METHOXYCARBONYL)1(2PHENYLETHYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD02104973
STK022403
ZINC000000781135
ZINC00781135
ZINC781135

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Available files

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