Vitas-M small molecule compound

5-bromo-3-hydroxy-3-[2-(8-methoxy-2-oxo-2H-chromen-3-yl)-2-oxoethyl]-1-methyl-1,3-dihydro-2H-indol-2-one

Catalog ID
STK042260
SMILES COc1cccc2c1oc(=O)c(c2)C(=O)CC1(O)c2cc(Br)ccc2N(C1=O)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 C21H16BrNO6 MW 458.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrNO6/c1-23-15-7-6-12(22)9-14(15)21(27,20(23)26)10-16(24)13-8-11-4-3-5-17(28-2)18(11)29-19(13)25/h3-9,27H,10H2,1-2H3
InChIKey
HEYAGYXKWUXLJX-UHFFFAOYSA-N
Synonyms

3(2(5BROMO3HYDROXY1METHYL2OXOINDOLIN3YL)ACETYL)8METHOXYCHROMEN2ONE
5BROMO3HYDROXY3(2(8METHOXY2OXO2HCHROMEN3YL)2OXOETHYL)1METHYL13DIHYDRO2HINDOL2ONE
5BROMO3HYDROXY3(2(8METHOXY2OXOCHROMEN3YL)2OXOETHYL)1METHYLINDOL2ONE
CN1C2=C(C=C(C=C2)Br)C(C1=O)(CC(=O)C3=CC4=C(C(=CC=C4)OC)OC3=O)O
COc1cccc2c1oc(=O)c(c2)C(=O)CC1(O)c2cc(Br)ccc2N(C1=O)C
InChI=1SC21H16BrNO6c123157612(22)914(15)21(2720(23)26)1016(24)1381143517(282)18(11)2919(13)25h3927H10H212H3
MFCD02604436
STK042260
ZINC000001112513
ZINC000001112514

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Available files

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