Vitas-M small molecule compound

2-(5-bromo-2-methoxyphenyl)-5-methyl-4H-3,1-benzoxazin-4-one

Catalog ID
STK277109
SMILES COc1ccc(cc1c1nc2cccc(c2c(=O)o1)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 C16H12BrNO3 MW 346.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrNO3/c1-9-4-3-5-12-14(9)16(19)21-15(18-12)11-8-10(17)6-7-13(11)20-2/h3-8H,1-2H3
InChIKey
PEOLLRWJGHDLRS-UHFFFAOYSA-N
Synonyms
669704-18-1
2(5BROMO2METHOXYPHENYL)5METHYL31BENZOXAZIN4ONE
2(5bromo2methoxyphenyl)5methyl4H31benzoxazin4one
669704181
CC1=C2C(=CC=C1)N=C(OC2=O)C3=C(C=CC(=C3)Br)OC
InChI=1SC16H12BrNO3c194351214(9)16(19)2115(1812)11810(17)6713(11)202h38H12H3
MFCD04091212
ZINC000000367886
ZINC00367886
ZINC367886

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Available files

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