Vitas-M small molecule compound
2-(1,3-benzodioxol-5-ylmethyl)-3-[(1-benzylpiperidin-4-yl)oxy]-2,3-dihydro-1H-isoindol-1-one
Catalog ID
STK041730
SMILES O=C1N(Cc2ccc3c(c2)OCO3)C(c2c1cccc2)OC1CCN(CC1)Cc1ccccc1
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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 C28H28N2O4 MW 456.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O4/c31-27-23-8-4-5-9-24(23)28(30(27)18-21-10-11-25-26(16-21)33-19-32-25)34-22-12-14-29(15-13-22)17-20-6-2-1-3-7-20/h1-11,16,22,28H,12-15,17-19H2InChIKey
KSOOGPDMMADJPE-UHFFFAOYSA-NSynonyms
2(13BENZODIOXOL5YLMETHYL)3((1BENZYLPIPERIDIN4YL)OXY)23DIHYDRO1HISOINDOL1ONE
2(13benzodioxol5ylmethyl)3(1benzylpiperidin4yl)oxy3Hisoindol1one
C1CN(CCC1OC2C3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5)CC6=CC=CC=C6
InChI=1SC28H28N2O4c312723845924(23)28(30(27)182110112526(1621)33193225)3422121429(151322)17206213720h111162228H12151719H2
MFCD08672141
O=C1N(Cc2ccc3c(c2)OCO3)C(c2c1cccc2)OC1CCN(CC1)Cc1ccccc1
STK041730
ZINC000009425543
ZINC000013942539
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