Vitas-M small molecule compound

4-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-methyl-2H-chromen-2-one

Catalog ID
STK573008
SMILES Fc1ccc(cc1)N1CCN(CC1)Cc1cc(=O)oc2c1ccc(c2)C

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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 C21H21FN2O2 MW 352.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN2O2/c1-15-2-7-19-16(13-21(25)26-20(19)12-15)14-23-8-10-24(11-9-23)18-5-3-17(22)4-6-18/h2-7,12-13H,8-11,14H2,1H3
InChIKey
XXFZWKRWEKBLNI-UHFFFAOYSA-N
Synonyms
877781-98-1
4((4(4fluorophenyl)piperazin1yl)methyl)7methyl2Hchromen2one
4((4(4FLUOROPHENYL)PIPERAZIN1YL)METHYL)7METHYLCHROMEN2ONE
4((4(4FLUOROPHENYL)PIPERAZINYL)METHYL)7METHYLCHROMEN2ONE
877781981
CC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)C4=CC=C(C=C4)F
InChI=1SC21H21FN2O2c115271916(1321(25)2620(19)1215)142381024(11923)185317(22)4618h271213H81114H21H3
MFCD04874151
ZINC000054105879
ZINC54105879

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Available files

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