Vitas-M small molecule compound

methyl 3-(3-chloro-4-hydroxyphenyl)-3-(4-hydroxy-2-oxo-2H-pyrido[1,2-a]pyrimidin-3-yl)propanoate

Catalog ID
STL411055
SMILES COC(=O)CC(c1c(=O)nc2n(c1O)cccc2)c1ccc(c(c1)Cl)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 C18H15ClN2O5 MW 374.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN2O5/c1-26-15(23)9-11(10-5-6-13(22)12(19)8-10)16-17(24)20-14-4-2-3-7-21(14)18(16)25/h2-8,11,22,25H,9H2,1H3
InChIKey
SZKNPSCQXZTILC-UHFFFAOYSA-N
Synonyms

COC(=O)CC(C1=CC(=C(C=C1)O)Cl)C2=C(N3C=CC=CC3=NC2=O)O
InChI=1SC18H15ClN2O5c12615(23)911(105613(22)12(19)810)1617(24)2014423721(14)18(16)25h28112225H9H21H3
methyl3(3chloro4hydroxyphenyl)3(4hydroxy2oxo2Hpyrido(12a)pyrimidin3yl)propanoate
methyl3(3chloro4hydroxyphenyl)3(4hydroxy2oxopyrido(12a)pyrimidin3yl)propanoate
MFCD30706513
ZINC000205980337
ZINC000205980352

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Available files

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