Vitas-M small molecule compound

1-butyl-3-[2-(2,4-dimethylphenyl)-2-oxoethyl]-3-hydroxy-1,3-dihydro-2H-indol-2-one

Catalog ID
STK214405
SMILES CCCCN1c2ccccc2C(C1=O)(O)CC(=O)c1ccc(cc1C)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 C22H25NO3 MW 351.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25NO3/c1-4-5-12-23-19-9-7-6-8-18(19)22(26,21(23)25)14-20(24)17-11-10-15(2)13-16(17)3/h6-11,13,26H,4-5,12,14H2,1-3H3
InChIKey
KCYBJHAPOJVVMR-UHFFFAOYSA-N
Synonyms

1BUTYL3(2(24DIMETHYLPHENYL)2OXOETHYL)3HYDROXY13DIHYDRO2HINDOL2ONE
1butyl3(2(24dimethylphenyl)2oxoethyl)3hydroxyindol2one
CCCCN1C2=CC=CC=C2C(C1=O)(CC(=O)C3=C(C=C(C=C3)C)C)O
InChI=1SC22H25NO3c145122319976818(19)22(2621(23)25)1420(24)17111015(2)1316(17)3h6111326H451214H213H3
MFCD08086126
ZINC000004784341
ZINC000004784343

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Available files

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