Vitas-M small molecule compound

1,8,8-trimethyl-3-{4-[4-(pyridin-2-yl)piperazin-1-yl]butyl}-3-azabicyclo[3.2.1]octane-2,4-dione

Catalog ID
STK012745
SMILES O=C1N(CCCCN2CCN(CC2)c2ccccn2)C(=O)C2(C(C1CC2)(C)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 C23H34N4O2 MW 398.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H34N4O2/c1-22(2)18-9-10-23(22,3)21(29)27(20(18)28)13-7-6-12-25-14-16-26(17-15-25)19-8-4-5-11-24-19/h4-5,8,11,18H,6-7,9-10,12-17H2,1-3H3
InChIKey
NCMIPRCQUMYAEC-UHFFFAOYSA-N
Synonyms
142348-14-9
(1S5S)188trimethyl3(4(4(pyridin2yl)piperazin1yl)butyl)3azabicyclo(321)octane24dionedihydrochloride
142348149
188TRIMETHYL3(4(4(PYRIDIN2YL)PIPERAZIN1YL)BUTYL)3AZABICYCLO(321)OCTANE24DIONE
188TRIMETHYL3(4(4PYRIDIN2YLPIPERAZIN1YL)BUTYL)3AZABICYCLO(321)OCTANE24DIONE
3(4(4(2PYRIDYL)1PIPERAZINYL)BUTYL)188TRIMETHYL3AZABICYCLO(321)OCTANE24DIONE
588TRIMETHYL3(4(4PYRIDIN2YLPIPERAZIN1YL)BUTYL)3AZABICYCLO(321)OCTANE24DIONE
CC1(C2CCC1(C(=O)N(C2=O)CCCCN3CCN(CC3)C4=CC=CC=N4)C)C
InChI=1SC23H34N4O2c122(2)1891023(223)21(29)27(20(18)28)13761225141626(171525)19845112419h4581118H679101217H213H3
MFCD00946583
O=C1N(CCCCN2CCN(CC2)c2ccccn2)C(=O)(C@@)2(C(C1CC2)(C)C)CClCl
O=C1N(CCCCN2CCN(CC2)c2ccccn2)C(=O)C2(C(C1CC2)(C)C)C
STK012745
ZINC000018275956

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Available files

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