Vitas-M small molecule compound

dimethyl 1-(3-chloro-4-fluorophenyl)-4-phenyl-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK406044
SMILES COC(=O)C1=CN(C=C(C1c1ccccc1)C(=O)OC)c1ccc(c(c1)Cl)F

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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 C21H17ClFNO4 MW 401.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClFNO4/c1-27-20(25)15-11-24(14-8-9-18(23)17(22)10-14)12-16(21(26)28-2)19(15)13-6-4-3-5-7-13/h3-12,19H,1-2H3
InChIKey
SDZIXZROTIBSAQ-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CN(C=C(C1C2=CC=CC=C2)C(=O)OC)C3=CC(=C(C=C3)F)Cl
dimethyl1(3chloro4fluorophenyl)4phenyl14dihydropyridine35dicarboxylate
DIMETHYL1(3CHLORO4FLUOROPHENYL)4PHENYL4HPYRIDINE35DICARBOXYLATE
InChI=1SC21H17ClFNO4c12720(25)151124(148918(23)17(22)1014)1216(21(26)282)19(15)136435713h31219H12H3
METHYL1(3CHLORO4FLUOROPHENYL)5(METHOXYCARBONYL)4PHENYL14DIHYDROPYRIDINE3CARBOXYLATE
MFCD04216631
ZINC000001132868
ZINC01132868
ZINC1132868

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Available files

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