Vitas-M small molecule compound

1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2,2-dimethylbutan-1-one

Catalog ID
STK016866
SMILES CCC(C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)(C)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 C18H26N2O3 MW 318.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26N2O3/c1-4-18(2,3)17(21)20-9-7-19(8-10-20)12-14-5-6-15-16(11-14)23-13-22-15/h5-6,11H,4,7-10,12-13H2,1-3H3
InChIKey
OBEBUMDTSHZUKP-UHFFFAOYSA-N
Synonyms
349540-23-4
1(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)22DIMETHYLBUTAN1ONE
1(4(2HBENZO(34D)13DIOXOLEN5YLMETHYL)PIPERAZINYL)22DIMETHYLBUTAN1ONE
349540234
CCC(C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)(C)C
CCC(C)(C)C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3
InChI=1SC18H26N2O3c1418(23)17(21)209719(81020)1214561516(1114)23132215h5611H47101213H213H3
MFCD02736140
STK016866
ZINC000019907426
ZINC19907426

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Available files

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