Vitas-M small molecule compound

methyl (3,4-dimethoxyphenyl){[3-oxo-2-(2-phenylethyl)-2,3-dihydro-1H-isoindol-1-yl]amino}acetate

Catalog ID
STK045591
SMILES COC(=O)C(c1ccc(c(c1)OC)OC)NC1N(CCc2ccccc2)C(=O)c2c1cccc2

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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 C27H28N2O5 MW 460.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O5/c1-32-22-14-13-19(17-23(22)33-2)24(27(31)34-3)28-25-20-11-7-8-12-21(20)26(30)29(25)16-15-18-9-5-4-6-10-18/h4-14,17,24-25,28H,15-16H2,1-3H3
InChIKey
XITZHQKPEJJQPR-UHFFFAOYSA-N
Synonyms

COC(=O)C(c1ccc(c(c1)OC)OC)NC1N(CCc2ccccc2)C(=O)c2c1cccc2
COC1=C(C=C(C=C1)C(C(=O)OC)NC2C3=CC=CC=C3C(=O)N2CCC4=CC=CC=C4)OC
InChI=1SC27H28N2O5c13222141319(1723(22)332)24(27(31)343)28252011781221(20)26(30)29(25)16151895461018h41417242528H1516H213H3
METHYL(34DIMETHOXYPHENYL)((3OXO2(2PHENYLETHYL)23DIHYDRO1HISOINDOL1YL)AMINO)ACETATE
methyl2(34dimethoxyphenyl)2((3oxo2(2phenylethyl)1Hisoindol1yl)amino)acetate
MFCD11851009
STK045591
ZINC000013942937
ZINC000095483068

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Available files

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