Vitas-M small molecule compound

methyl 5-[3-amino-1-(naphthalen-1-yl)-3-oxopropyl]-4,6-dihydroxypyridine-3-carboxylate

Catalog ID
STL424839
SMILES COC(=O)c1cnc(c(c1O)C(c1cccc2c1cccc2)CC(=O)N)O

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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 C20H18N2O5 MW 366.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5/c1-27-20(26)15-10-22-19(25)17(18(15)24)14(9-16(21)23)13-8-4-6-11-5-2-3-7-12(11)13/h2-8,10,14H,9H2,1H3,(H2,21,23)(H2,22,24,25)
InChIKey
CPCLKAHTBXWXPL-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CNC(=O)C(=C1O)C(CC(=O)N)C2=CC=CC3=CC=CC=C32
InChI=1SC20H18N2O5c12720(26)15102219(25)17(18(15)24)14(916(21)23)1384611523712(11)13h281014H9H21H3(H22123)(H2222425)
methyl5(3amino1(naphthalen1yl)3oxopropyl)46dihydroxypyridine3carboxylate
methyl5(3amino1naphthalen1yl3oxopropyl)4hydroxy6oxo1Hpyridine3carboxylate
MFCD30709602
ZINC000252481612
ZINC000252481613

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Available files

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