Vitas-M small molecule compound

dimethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-propyl-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK405305
SMILES CCCN1C=C(C(=O)OC)C(C(=C1)C(=O)OC)c1cc(Br)c(c(c1)OC)O

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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 C19H22BrNO6 MW 440.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22BrNO6/c1-5-6-21-9-12(18(23)26-3)16(13(10-21)19(24)27-4)11-7-14(20)17(22)15(8-11)25-2/h7-10,16,22H,5-6H2,1-4H3
InChIKey
GFRAEFZMDWFYFZ-UHFFFAOYSA-N
Synonyms

CCCN1C=C(C(C(=C1)C(=O)OC)C2=CC(=C(C(=C2)Br)O)OC)C(=O)OC
dimethyl4(3bromo4hydroxy5methoxyphenyl)1propyl14dihydropyridine35dicarboxylate
DIMETHYL4(3BROMO4HYDROXY5METHOXYPHENYL)1PROPYL4HPYRIDINE35DICARBOXYLATE
InChI=1SC19H22BrNO6c15621912(18(23)263)16(13(1021)19(24)274)11714(20)17(22)15(811)252h7101622H56H214H3
METHYL4(3BROMO4HYDROXY5METHOXYPHENYL)5(METHOXYCARBONYL)1PROPYL14DIHYDROPYRIDINE3CARBOXYLATE
MFCD03999274
ZINC000001140913
ZINC01140913
ZINC1140913

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Available files

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