Vitas-M small molecule compound

dimethyl 1-(4-fluorobenzyl)-4-[4-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK075665
SMILES COC(=O)C1=CN(Cc2ccc(cc2)F)C=C(C1c1ccc(cc1)C(F)(F)F)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 C23H19F4NO4 MW 449.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19F4NO4/c1-31-21(29)18-12-28(11-14-3-9-17(24)10-4-14)13-19(22(30)32-2)20(18)15-5-7-16(8-6-15)23(25,26)27/h3-10,12-13,20H,11H2,1-2H3
InChIKey
CVLVHBWNCFQNAI-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CN(C=C(C1C2=CC=C(C=C2)C(F)(F)F)C(=O)OC)CC3=CC=C(C=C3)F
COC(=O)C1=CN(Cc2ccc(cc2)F)C=C(C1c1ccc(cc1)C(F)(F)F)C(=O)OC
DIMETHYL1((4FLUOROPHENYL)METHYL)4(4(TRIFLUOROMETHYL)PHENYL)4HPYRIDINE35DICARBOXYLATE
DIMETHYL1(4FLUOROBENZYL)4(4(TRIFLUOROMETHYL)PHENYL)14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC23H19F4NO4c13121(29)181228(11143917(24)10414)1319(22(30)322)20(18)155716(8615)23(2526)27h310121320H11H212H3
METHYL1((4FLUOROPHENYL)METHYL)5(METHOXYCARBONYL)4(4(TRIFLUOROMETHYL)PHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD02105343
STK075665
ZINC000001170898
ZINC01170898
ZINC1170898

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Available files

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