Vitas-M small molecule compound

ethyl 5-[3-(dicyclohexylamino)-2-hydroxypropoxy]-1,2-dimethyl-1H-indole-3-carboxylate

Catalog ID
STK944883
SMILES CCOC(=O)c1c(C)n(c2c1cc(OCC(CN(C1CCCCC1)C1CCCCC1)O)cc2)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 C28H42N2O4 MW 470.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H42N2O4/c1-4-33-28(32)27-20(2)29(3)26-16-15-24(17-25(26)27)34-19-23(31)18-30(21-11-7-5-8-12-21)22-13-9-6-10-14-22/h15-17,21-23,31H,4-14,18-19H2,1-3H3
InChIKey
MYCMAMOQCVUUPV-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN(C3CCCCC3)C4CCCCC4)O)C)C
ethyl5(3(dicyclohexylamino)2hydroxypropoxy)12dimethyl1Hindole3carboxylate
ETHYL5(3(DICYCLOHEXYLAMINO)2HYDROXYPROPOXY)12DIMETHYLINDOLE3CARBOXYLATE
InChI=1SC28H42N2O4c143328(32)2720(2)29(3)26161524(1725(26)27)341923(31)1830(21117581221)221396101422h1517212331H4141819H213H3
MFCD12966113
ZINC000028296709
ZINC000028296711

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Available files

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