Vitas-M small molecule compound

ethyl 4-[(4-bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carboxylate

Catalog ID
STK203850
SMILES CCOC(=O)N1CCN(CC1)C(=O)COc1cc(C)c(c(c1)C)Br

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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 C17H23BrN2O4 MW 399.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23BrN2O4/c1-4-23-17(22)20-7-5-19(6-8-20)15(21)11-24-14-9-12(2)16(18)13(3)10-14/h9-10H,4-8,11H2,1-3H3
InChIKey
CTMKYHOYEPGRSS-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=O)COC2=CC(=C(C(=C2)C)Br)C
ethyl4((4bromo35dimethylphenoxy)acetyl)piperazine1carboxylate
ETHYL4(2(4BROMO35DIMETHYLPHENOXY)ACETYL)PIPERAZINE1CARBOXYLATE
InChI=1SC17H23BrN2O4c142317(22)207519(6820)15(21)112414912(2)16(18)13(3)1014h910H4811H213H3
MFCD03708582
ZINC000000795566
ZINC00795566
ZINC795566

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Available files

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