Vitas-M small molecule compound

(4-nitrophenyl){4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone

Catalog ID
STK063871
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)c1cccc(c1)C(F)(F)F

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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 C18H16F3N3O3 MW 379.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16F3N3O3/c19-18(20,21)14-2-1-3-16(12-14)22-8-10-23(11-9-22)17(25)13-4-6-15(7-5-13)24(26)27/h1-7,12H,8-11H2
InChIKey
VNBQDMDSIVCSEK-UHFFFAOYSA-N
Synonyms
432538-57-3
(4NITROPHENYL)(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)METHANONE
432538573
4NITROPHENYL4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZINYLKETONE
C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC18H16F3N3O3c1918(2021)1421316(1214)2281023(11922)17(25)134615(7513)24(26)27h1712H811H2
MFCD00248338
O=C(c1ccc(cc1)(N+)(=O)(O))N1CCN(CC1)c1cccc(c1)C(F)(F)F
STK063871
ZINC000000650478
ZINC00650478
ZINC650478

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Available files

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