Vitas-M small molecule compound

2-[4-(propan-2-yl)phenoxy]-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-1-one

Catalog ID
STK488743
SMILES O=C(C(Oc1ccc(cc1)C(C)C)C)N1CCN(CC1)c1ccccn1

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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 C21H27N3O2 MW 353.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O2/c1-16(2)18-7-9-19(10-8-18)26-17(3)21(25)24-14-12-23(13-15-24)20-6-4-5-11-22-20/h4-11,16-17H,12-15H2,1-3H3
InChIKey
DINGMNSMFXJXJV-UHFFFAOYSA-N
Synonyms

2(4(METHYLETHYL)PHENOXY)1(4(2PYRIDYL)PIPERAZINYL)PROPAN1ONE
2(4(propan2yl)phenoxy)1(4(pyridin2yl)piperazin1yl)propan1one
2(4propan2ylphenoxy)1(4pyridin2ylpiperazin1yl)propan1one
CC(C)C1=CC=C(C=C1)OC(C)C(=O)N2CCN(CC2)C3=CC=CC=N3
InChI=1SC21H27N3O2c116(2)187919(10818)2617(3)21(25)24141223(131524)20645112220h4111617H1215H213H3
MFCD09451570
ZINC000012383011
ZINC000012383012

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Available files

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