Vitas-M small molecule compound

benzene-1,3,5-triyltris{[4-(2-fluorophenyl)piperazin-1-yl]methanone}

Catalog ID
STK423476
SMILES O=C(c1cc(cc(c1)C(=O)N1CCN(CC1)c1ccccc1F)C(=O)N1CCN(CC1)c1ccccc1F)N1CCN(CC1)c1ccccc1F

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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 C39H39F3N6O3 MW 696.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H39F3N6O3/c40-31-7-1-4-10-34(31)43-13-19-46(20-14-43)37(49)28-25-29(38(50)47-21-15-44(16-22-47)35-11-5-2-8-32(35)41)27-30(26-28)39(51)48-23-17-45(18-24-48)36-12-6-3-9-33(36)42/h1-12,25-27H,13-24H2
InChIKey
KZUQZHBUSDZLCD-UHFFFAOYSA-N
Synonyms

(35BIS(4(2FLUOROPHENYL)PIPERAZINE1CARBONYL)PHENYL)(4(2FLUOROPHENYL)PIPERAZIN1YL)METHANONE
1(35BIS((4(2FLUOROPHENYL)1PIPERAZINYL)CARBONYL)BENZOYL)4(2FLUOROPHENYL)PIPERAZINE
35BIS((4(2FLUOROPHENYL)PIPERAZINYL)CARBONYL)PHENYL4(2FLUOROPHENYL)PIPERAZINYLKETONE
benzene135triyltris((4(2fluorophenyl)piperazin1yl)methanone)
C1CN(CCN1C2=CC=CC=C2F)C(=O)C3=CC(=CC(=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5F)C(=O)N6CCN(CC6)C7=CC=CC=C7F
InChI=1SC39H39F3N6O3c40317141034(31)43131946(201443)37(49)282529(38(50)47211544(162247)351152832(35)41)2730(2628)39(51)48231745(182448)361263933(36)42h1122527H1324H2
MFCD02177211
ZINC000008455792
ZINC08455792
ZINC8455792

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Available files

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