Vitas-M small molecule compound

2-{2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl}hexahydro-1H-isoindole-1,3(2H)-dione

Catalog ID
STK046805
SMILES O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CN1C(=O)C2C(C1=O)CCCC2

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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 C22H27N3O5 MW 413.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O5/c26-20(13-25-21(27)16-3-1-2-4-17(16)22(25)28)24-9-7-23(8-10-24)12-15-5-6-18-19(11-15)30-14-29-18/h5-6,11,16-17H,1-4,7-10,12-14H2
InChIKey
NZBVTTOSPFJGQK-UHFFFAOYSA-N
Synonyms

(3AR7AR)2(2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)2OXOETHYL)HEXAHYDRO1HISOINDOLE13(2H)DIONE
(3AS7AS)2(2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)2OXOETHYL)HEXAHYDRO1HISOINDOLE13(2H)DIONE
2(2(4(13benzodioxol5ylmethyl)piperazin1yl)2oxoethyl)3a45677ahexahydroisoindole13dione
2(2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)2OXOETHYL)HEXAHYDRO1HISOINDOLE13(2H)DIONE
C1CCC2C(C1)C(=O)N(C2=O)CC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5
InChI=1SC22H27N3O5c2620(132521(27)16312417(16)22(25)28)249723(81024)1215561819(1115)30142918h56111617H147101214H2
MFCD03321663
STK046805
ZINC000013465240
ZINC000096006149

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Available files

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