Vitas-M small molecule compound

methyl (1-{[2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]carbonyl}piperidin-4-yl)acetate

Catalog ID
STL251138
SMILES COC(=O)CC1CCN(CC1)C(=O)c1cn(c2ccc(cc2)OC)c(=O)c2c1cccc2

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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 C25H26N2O5 MW 434.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O5/c1-31-19-9-7-18(8-10-19)27-16-22(20-5-3-4-6-21(20)25(27)30)24(29)26-13-11-17(12-14-26)15-23(28)32-2/h3-10,16-17H,11-15H2,1-2H3
InChIKey
HUVINKWWCGHYIY-UHFFFAOYSA-N
Synonyms
1374546-80-1
1374546801
COC1=CC=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)N4CCC(CC4)CC(=O)OC
InChI=1SC25H26N2O5c131199718(81019)271622(20534621(20)25(27)30)24(29)26131117(121426)1523(28)322h3101617H1115H212H3
methyl(1((2(4methoxyphenyl)1oxo12dihydroisoquinolin4yl)carbonyl)piperidin4yl)acetate
methyl2(1(2(4methoxyphenyl)1oxo12dihydroisoquinoline4carbonyl)piperidin4yl)acetate
methyl2(1(2(4methoxyphenyl)1oxoisoquinoline4carbonyl)piperidin4yl)acetate
MFCD22203347
ZINC000072404871
ZINC72404871

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Available files

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