Vitas-M small molecule compound

hexyl 3-(1,4-dioxo-3,4-dihydrophthalazin-2(1H)-yl)propanoate

Catalog ID
STK538357
SMILES CCCCCCOC(=O)CCn1[nH]c(=O)c2c(c1=O)cccc2

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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 C17H22N2O4 MW 318.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O4/c1-2-3-4-7-12-23-15(20)10-11-19-17(22)14-9-6-5-8-13(14)16(21)18-19/h5-6,8-9H,2-4,7,10-12H2,1H3,(H,18,21)
InChIKey
WEJGELKFGRHMBP-UHFFFAOYSA-N
Synonyms
439141-63-6
439141636
CCCCCCOC(=O)CCn1(nH)c(=O)c2c(c1=O)cccc2
CCCCCCOC(=O)CCN1C(=O)C2=CC=CC=C2C(=O)N1
hexyl3(14dioxo34dihydrophthalazin2(1H)yl)propanoate
HEXYL3(14DIOXO3HPHTHALAZIN2YL)PROPANOATE
InChI=1SC17H22N2O4c12347122315(20)10111917(22)14965813(14)16(21)1819h5689H2471012H21H3(H1821)
MFCD02763609
ZINC000002348511
ZINC2348511

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Available files

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