Vitas-M small molecule compound

methyl 4-{3-[(1,3-benzodioxol-5-ylmethyl)amino]-1-(4-methoxy-1H-indol-3-yl)-3-oxopropyl}benzoate

Catalog ID
STL539322
SMILES COC(=O)c1ccc(cc1)C(c1c[nH]c2c1c(OC)ccc2)CC(=O)NCc1ccc2c(c1)OCO2

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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 C28H26N2O6 MW 486.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O6/c1-33-24-5-3-4-22-27(24)21(15-29-22)20(18-7-9-19(10-8-18)28(32)34-2)13-26(31)30-14-17-6-11-23-25(12-17)36-16-35-23/h3-12,15,20,29H,13-14,16H2,1-2H3,(H,30,31)
InChIKey
RIJNGSDPGOPJNR-UHFFFAOYSA-N
Synonyms
1435907-00-8
1435907008
71754615
COC(=O)c1ccc(cc1)C(c1c(nH)c2c1c(OC)ccc2)CC(=O)NCc1ccc2c(c1)OCO2
InChI=1SC28H26N2O6c133245342227(24)21(152922)20(187919(10818)28(32)342)1326(31)3014176112325(1217)36163523h312152029H131416H212H3(H3031)
methyl4(3((13benzodioxol5ylmethyl)amino)1(4methoxy1Hindol3yl)3oxopropyl)benzoate
METHYL4(3((BENZO(D)(13)DIOXOL5YLMETHYL)AMINO)1(4METHOXY1HINDOL3YL)3OXOPROPYL)BENZOATE
methyl4(3(13benzodioxol5ylmethylamino)1(4methoxy1~(H)indol3yl)3oxopropyl)benzoate
MFCD23136272
ZINC000085875892
ZINC000085875899

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Available files

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