Vitas-M small molecule compound

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

Catalog ID
STK402810
SMILES COC(=O)C1=CN(C=C(C1c1cc(Br)c(c(c1)OC)O)C(=O)OC)C1CC1

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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 C19H20BrNO6 MW 438.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20BrNO6/c1-25-15-7-10(6-14(20)17(15)22)16-12(18(23)26-2)8-21(11-4-5-11)9-13(16)19(24)27-3/h6-9,11,16,22H,4-5H2,1-3H3
InChIKey
OBUWLMYTMFQLSM-UHFFFAOYSA-N
Synonyms
421574-77-8
421574778
COC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OC)C3CC3)C(=O)OC)Br)O
dimethyl4(3bromo4hydroxy5methoxyphenyl)1cyclopropyl14dihydropyridine35dicarboxylate
DIMETHYL4(3BROMO4HYDROXY5METHOXYPHENYL)1CYCLOPROPYL4HPYRIDINE35DICARBOXYLATE
InChI=1SC19H20BrNO6c12515710(614(20)17(15)22)1612(18(23)262)821(114511)913(16)19(24)273h69111622H45H213H3
MFCD02868527
ZINC000001151752
ZINC01151752
ZINC1151752

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Available files

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