Vitas-M small molecule compound

3-benzyl-3-hydroxy-2-(3-methylbutyl)-2,3-dihydro-1H-isoindol-1-one

Catalog ID
STK134165
SMILES CC(CCN1C(=O)c2c(C1(O)Cc1ccccc1)cccc2)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 C20H23NO2 MW 309.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO2/c1-15(2)12-13-21-19(22)17-10-6-7-11-18(17)20(21,23)14-16-8-4-3-5-9-16/h3-11,15,23H,12-14H2,1-2H3
InChIKey
HCMNXGZMFWHCEN-UHFFFAOYSA-N
Synonyms

(3R)3BENZYL3HYDROXY2(3METHYLBUTYL)23DIHYDRO1HISOINDOL1ONE
(3S)3BENZYL3HYDROXY2(3METHYLBUTYL)23DIHYDRO1HISOINDOL1ONE
3BENZYL3HYDROXY2(3METHYLBUTYL)23DIHYDRO1HISOINDOL1ONE
3BENZYL3HYDROXY2(3METHYLBUTYL)ISOINDOL1ONE
CC(C)CCN1C(=O)C2=CC=CC=C2C1(CC3=CC=CC=C3)O
InChI=1SC20H23NO2c115(2)12132119(22)1710671118(17)20(2123)14168435916h3111523H1214H212H3
MFCD04060223
ZINC000001441209
ZINC000001441210

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Available files

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