Vitas-M small molecule compound

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

Catalog ID
STK944863
SMILES CCOC(=O)c1c(C)n(c2c1cc(OCC(CNC1CCCCC1)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 C22H32N2O4 MW 388.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H32N2O4/c1-4-27-22(26)21-15(2)24(3)20-11-10-18(12-19(20)21)28-14-17(25)13-23-16-8-6-5-7-9-16/h10-12,16-17,23,25H,4-9,13-14H2,1-3H3
InChIKey
AYGCNDGOZRPCAG-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CNC3CCCCC3)O)C)C
ethyl5(3(cyclohexylamino)2hydroxypropoxy)12dimethyl1Hindole3carboxylate
ETHYL5(3(CYCLOHEXYLAMINO)2HYDROXYPROPOXY)12DIMETHYLINDOLE3CARBOXYLATE
InChI=1SC22H32N2O4c142722(26)2115(2)24(3)20111018(1219(20)21)281417(25)1323168657916h101216172325H491314H213H3
MFCD05239870
ZINC000003655839
ZINC000003655840

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Available files

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