Vitas-M small molecule compound

ethyl 6-bromo-2,4-bis[(dimethylamino)methyl]-5-hydroxy-1-phenyl-1H-indole-3-carboxylate

Catalog ID
STK683586
SMILES CCOC(=O)c1c(CN(C)C)n(c2c1c(CN(C)C)c(O)c(c2)Br)c1ccccc1

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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 C23H28BrN3O3 MW 474.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28BrN3O3/c1-6-30-23(29)21-19(14-26(4)5)27(15-10-8-7-9-11-15)18-12-17(24)22(28)16(20(18)21)13-25(2)3/h7-12,28H,6,13-14H2,1-5H3
InChIKey
XONZZIUDFBGLIC-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN(C)C)O)Br)C3=CC=CC=C3)CN(C)C
ethyl6bromo24bis((dimethylamino)methyl)5hydroxy1phenyl1Hindole3carboxylate
ethyl6bromo24bis((dimethylamino)methyl)5hydroxy1phenylindole3carboxylate
ETHYL6BROMO24BIS(DIMETHYLAMINOMETHYL)5HYDROXY1PHENYLINDOLE3CARBOXYLATE
InChI=1SC23H28BrN3O3c163023(29)2119(1426(4)5)27(15108791115)181217(24)22(28)16(20(18)21)1325(2)3h71228H61314H215H3
MFCD05042282
ZINC000012413720
ZINC12413720

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Available files

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