Vitas-M small molecule compound

(3-fluoro-4-methylphenyl)[4-(pyrimidin-2-yl)piperazin-1-yl]methanone

Catalog ID
STL188895
SMILES O=C(c1ccc(c(c1)F)C)N1CCN(CC1)c1ncccn1

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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 C16H17FN4O MW 300.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17FN4O/c1-12-3-4-13(11-14(12)17)15(22)20-7-9-21(10-8-20)16-18-5-2-6-19-16/h2-6,11H,7-10H2,1H3
InChIKey
PKRIJEPSCILJKW-UHFFFAOYSA-N
Synonyms
1043205-24-8
(3fluoro4methylphenyl)(4(pyrimidin2yl)piperazin1yl)methanone
(3FLUORO4METHYLPHENYL)(4PYRIMIDIN2YLPIPERAZIN1YL)METHANONE
1043205248
CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3)F
InChI=1SC16H17FN4Oc1123413(1114(12)17)15(22)207921(10820)16185261916h2611H710H21H3
MFCD12325227
ZINC000007955679
ZINC07955679
ZINC7955679

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Available files

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