Vitas-M small molecule compound

2-(4-chloro-3-methylphenoxy)-1-(4-ethylpiperazin-1-yl)propan-1-one

Catalog ID
STL382409
SMILES CCN1CCN(CC1)C(=O)C(Oc1ccc(c(c1)C)Cl)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 C16H23ClN2O2 MW 310.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23ClN2O2/c1-4-18-7-9-19(10-8-18)16(20)13(3)21-14-5-6-15(17)12(2)11-14/h5-6,11,13H,4,7-10H2,1-3H3
InChIKey
CUWPNHRIUFBOEW-UHFFFAOYSA-N
Synonyms

2(4chloro3methylphenoxy)1(4ethylpiperazin1yl)propan1one
CCN1CCN(CC1)C(=O)C(C)OC2=CC(=C(C=C2)Cl)C
InChI=1SC16H23ClN2O2c14187919(10818)16(20)13(3)21145615(17)12(2)1114h561113H4710H213H3
MFCD03507577
ZINC000042359951
ZINC000042359956

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Available files

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