Vitas-M small molecule compound

diethyl 4-(3-bromo-4-methoxyphenyl)-1-[4-(dimethylamino)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK371343
SMILES CCOC(=O)C1=C(C)N(c2ccc(cc2)N(C)C)C(=C(C1c1ccc(c(c1)Br)OC)C(=O)OCC)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 C28H33BrN2O5 MW 557.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33BrN2O5/c1-8-35-27(32)24-17(3)31(21-13-11-20(12-14-21)30(5)6)18(4)25(28(33)36-9-2)26(24)19-10-15-23(34-7)22(29)16-19/h10-16,26H,8-9H2,1-7H3
InChIKey
GIPMTFSCOSJCOJ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(C(=C(C1C2=CC(=C(C=C2)OC)Br)C(=O)OCC)C)C3=CC=C(C=C3)N(C)C)C
DIETHYL4(3BROMO4(METHYLOXY)PHENYL)1(4(DIMETHYLAMINO)PHENYL)26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE
diethyl4(3bromo4methoxyphenyl)1(4(dimethylamino)phenyl)26dimethyl14dihydropyridine35dicarboxylate
diethyl4(3bromo4methoxyphenyl)1(4(dimethylamino)phenyl)26dimethyl4Hpyridine35dicarboxylate
DIETHYL4(3BROMO4METHOXYPHENYL)1(4DIMETHYLAMINOPHENYL)26DIMETHYL4HPYRIDINE35DICARBOXYLATE
ETHYL1(4(DIMETHYLAMINO)PHENYL)4(3BROMO4METHOXYPHENYL)5(ETHOXYCARBONYL)26DIMETHYL14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC28H33BrN2O5c183527(32)2417(3)31(21131120(121421)30(5)6)18(4)25(28(33)3692)26(24)19101523(347)22(29)1619h101626H89H217H3
MFCD00307232
ZINC000003142920
ZINC03142920
ZINC3142920

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Available files

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