Vitas-M small molecule compound

(3R)-3-bromo-2,6-dimethyl-1-(phenylcarbonyl)-2,3-dihydroquinolin-4(1H)-one

Catalog ID
STK026899
SMILES Cc1ccc2c(c1)C(=O)[C@@H](C(N2C(=O)c1ccccc1)C)Br

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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 C18H16BrNO2 MW 358.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrNO2/c1-11-8-9-15-14(10-11)17(21)16(19)12(2)20(15)18(22)13-6-4-3-5-7-13/h3-10,12,16H,1-2H3/t12?,16-/m1/s1
InChIKey
IBOKEPCJSUHPMN-PVQCJRHBSA-N
Synonyms

(3R)1benzoyl3bromo26dimethyl23dihydroquinolin4one
(3R)3BROMO26DIMETHYL1(PHENYLCARBONYL)23DIHYDROQUINOLIN4(1H)ONE
CC1C(C(=O)C2=C(N1C(=O)C3=CC=CC=C3)C=CC(=C2)C)Br
Cc1ccc2c(c1)C(=O)(C@@H)(C(N2C(=O)c1ccccc1)C)Br
InChI=1SC18H16BrNO2c111891514(1011)17(21)16(19)12(2)20(15)18(22)136435713h3101216H12H3t12?16m1s1
MFCD08050106
STK026899
ZINC000004592926
ZINC000004592927

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Available files

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