Vitas-M small molecule compound

N-{3-chloro-4-[4-(pentafluorophenyl)piperazin-1-yl]phenyl}pentanamide

Catalog ID
STK389557
SMILES CCCCC(=O)Nc1ccc(c(c1)Cl)N1CCN(CC1)c1c(F)c(F)c(c(c1F)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 C21H21ClF5N3O MW 461.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClF5N3O/c1-2-3-4-15(31)28-12-5-6-14(13(22)11-12)29-7-9-30(10-8-29)21-19(26)17(24)16(23)18(25)20(21)27/h5-6,11H,2-4,7-10H2,1H3,(H,28,31)
InChIKey
BWTSKJXTPZICDT-UHFFFAOYSA-N
Synonyms

CCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=C(C(=C(C(=C3F)F)F)F)F)Cl
InChI=1SC21H21ClF5N3Oc123415(31)28125614(13(22)1112)297930(10829)2119(26)17(24)16(23)18(25)20(21)27h5611H24710H21H3(H2831)
MFCD03836762
N(3chloro4(4(23456pentafluorophenyl)piperazin1yl)phenyl)pentanamide
N(3chloro4(4(pentafluorophenyl)piperazin1yl)phenyl)pentanamide
ZINC000004122700
ZINC04122700
ZINC4122700

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Available files

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