Vitas-M small molecule compound

[5-fluoro-2-(1H-tetrazol-1-yl)phenyl][4-(pyrimidin-2-yl)piperazin-1-yl]methanone

Catalog ID
STK643807
SMILES Fc1ccc(c(c1)C(=O)N1CCN(CC1)c1ncccn1)n1cnnn1

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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 C16H15FN8O MW 354.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15FN8O/c17-12-2-3-14(25-11-20-21-22-25)13(10-12)15(26)23-6-8-24(9-7-23)16-18-4-1-5-19-16/h1-5,10-11H,6-9H2
InChIKey
BMXTVBPFDKYOQL-UHFFFAOYSA-N
Synonyms
1010910-26-5
(5fluoro2(1Htetrazol1yl)phenyl)(4(pyrimidin2yl)piperazin1yl)methanone
(5fluoro2(tetrazol1yl)phenyl)(4pyrimidin2ylpiperazin1yl)methanone
1010910265
C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(C=CC(=C3)F)N4C=NN=N4
InChI=1SC16H15FN8Oc17122314(251120212225)13(1012)15(26)236824(9723)16184151916h151011H69H2
MFCD12204830
ZINC000012409561
ZINC12409561

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Available files

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