Vitas-M small molecule compound

1-butyl-5-(4-fluorobenzyl)-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate

Catalog ID
STK222808
SMILES CCCCn1c(=O)c(Cc2ccc(cc2)F)c([nH]c1=O)[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 C15H16FN2O3 MW 291.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17FN2O3/c1-2-3-8-18-14(20)12(13(19)17-15(18)21)9-10-4-6-11(16)7-5-10/h4-7,19H,2-3,8-9H2,1H3,(H,17,21)/p-1
InChIKey
NGWPNIMPCQUDKJ-UHFFFAOYSA-M
Synonyms

1butyl5(4fluorobenzyl)26dioxo1236tetrahydropyrimidin4olate
CCCCn1c(=O)c(Cc2ccc(cc2)F)c((nH)c1=O)(O)
MFCD08673316
ZINC000018220053

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Available files

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