Vitas-M small molecule compound

diethyl 1-(4-ethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK074566
SMILES CCOC(=O)C1=CN(C=C(C1c1cccc(c1)C(F)(F)F)C(=O)OCC)c1ccc(cc1)OCC

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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 C26H26F3NO5 MW 489.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26F3NO5/c1-4-33-20-12-10-19(11-13-20)30-15-21(24(31)34-5-2)23(22(16-30)25(32)35-6-3)17-8-7-9-18(14-17)26(27,28)29/h7-16,23H,4-6H2,1-3H3
InChIKey
PPBBDBVGYVHRPU-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CN(C=C(C1c1cccc(c1)C(F)(F)F)C(=O)OCC)c1ccc(cc1)OCC
CCOC1=CC=C(C=C1)N2C=C(C(C(=C2)C(=O)OCC)C3=CC(=CC=C3)C(F)(F)F)C(=O)OCC
DIETHYL1(4ETHOXYPHENYL)4(3(TRIFLUOROMETHYL)PHENYL)14DIHYDROPYRIDINE35DICARBOXYLATE
DIETHYL1(4ETHOXYPHENYL)4(3(TRIFLUOROMETHYL)PHENYL)4HPYRIDINE35DICARBOXYLATE
ETHYL5(ETHOXYCARBONYL)1(4ETHOXYPHENYL)4(3(TRIFLUOROMETHYL)PHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC26H26F3NO5c143320121019(111320)301521(24(31)3452)23(22(1630)25(32)3563)1787918(1417)26(2728)29h71623H46H213H3
MFCD02104901
STK074566
ZINC000000710657
ZINC00710657
ZINC710657

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Available files

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