Vitas-M small molecule compound

ethyl 6-bromo-2-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-5-methoxy-1-methyl-1H-indole-3-carboxylate

Catalog ID
STK017001
SMILES OCCN1CCN(CC1)Cc1n(C)c2c(c1C(=O)OCC)cc(c(c2)Br)OC

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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 C20H28BrN3O4 MW 454.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28BrN3O4/c1-4-28-20(26)19-14-11-18(27-3)15(21)12-16(14)22(2)17(19)13-24-7-5-23(6-8-24)9-10-25/h11-12,25H,4-10,13H2,1-3H3
InChIKey
QKHSIGOGHUFURF-UHFFFAOYSA-N
Synonyms
313702-53-3
313702533
CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C)CN3CCN(CC3)CCO
ETHYL6BROMO2((4(2HYDROXYETHYL)PIPERAZIN1YL)METHYL)5METHOXY1METHYL1HINDOLE3CARBOXYLATE
ETHYL6BROMO2((4(2HYDROXYETHYL)PIPERAZIN1YL)METHYL)5METHOXY1METHYLINDOLE3CARBOXYLATE
InChI=1SC20H28BrN3O4c142820(26)19141118(273)15(21)1216(14)22(2)17(19)13247523(6824)91025h111225H41013H213H3
MFCD01606358
OCCN1CCN(CC1)Cc1n(C)c2c(c1C(=O)OCC)cc(c(c2)Br)OC
STK017001
ZINC000096901952
ZINC96901952

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Available files

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