Vitas-M small molecule compound

dimethyl 4-(5-bromo-2-methoxyphenyl)-1-(4-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK404180
SMILES COC(=O)C1=CN(C=C(C1c1cc(Br)ccc1OC)C(=O)OC)c1ccc(cc1)C

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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 C23H22BrNO5 MW 472.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrNO5/c1-14-5-8-16(9-6-14)25-12-18(22(26)29-3)21(19(13-25)23(27)30-4)17-11-15(24)7-10-20(17)28-2/h5-13,21H,1-4H3
InChIKey
GKWBQJNTPJCWIK-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)N2C=C(C(C(=C2)C(=O)OC)C3=C(C=CC(=C3)Br)OC)C(=O)OC
dimethyl4(5bromo2methoxyphenyl)1(4methylphenyl)14dihydropyridine35dicarboxylate
DIMETHYL4(5BROMO2METHOXYPHENYL)1(4METHYLPHENYL)4HPYRIDINE35DICARBOXYLATE
InChI=1SC23H22BrNO5c1145816(9614)251218(22(26)293)21(19(1325)23(27)304)171115(24)71020(17)282h51321H14H3
METHYL4(5BROMO2METHOXYPHENYL)5(METHOXYCARBONYL)1(4METHYLPHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD03717487
ZINC000001118614
ZINC01118614
ZINC1118614

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Available files

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