Vitas-M small molecule compound

(5E)-5-{[1-(3-chloropropyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-2,6-dihydroxypyrimidin-4(5H)-one

Catalog ID
STK568416
SMILES ClCCCN1CCc2c1ccc(c2)/C=C/1\C(=NC(=NC1=O)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 C16H16ClN3O3 MW 333.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN3O3/c17-5-1-6-20-7-4-11-8-10(2-3-13(11)20)9-12-14(21)18-16(23)19-15(12)22/h2-3,8-9H,1,4-7H2,(H2,18,19,21,22,23)
InChIKey
SEDRPSQMPZBUSJ-UHFFFAOYSA-N
Synonyms
577988-41-1
(5E)5((1(3chloropropyl)23dihydro1Hindol5yl)methylidene)26dihydroxypyrimidin4(5H)one
ClCCCN1CCc2c1ccc(c2)C=C1C(=NC(=NC1=O)O)O
MFCD05736825
ZINC000002337309

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Available files

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