Vitas-M small molecule compound

7,8-dibromo-4-chloro-3-fluoro-1-[(4-phenylbut-3-yn-1-yl)oxy][1,4]benzodioxino[2,3-c]pyridine

Catalog ID
STL240897
SMILES Clc1c(F)nc(c2c1Oc1cc(Br)c(cc1O2)Br)OCCC#Cc1ccccc1

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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 C21H11Br2ClFNO3 MW 539.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H11Br2ClFNO3/c22-13-10-15-16(11-14(13)23)29-19-18(28-15)17(24)20(25)26-21(19)27-9-5-4-8-12-6-2-1-3-7-12/h1-3,6-7,10-11H,5,9H2
InChIKey
GITPSSIFBHKTFH-UHFFFAOYSA-N
Synonyms
671771-43-0
671771430
78dibromo4chloro3fluoro1((4phenylbut3yn1yl)oxy)(14)benzodioxino(23c)pyridine
78dibromo4chloro3fluoro1((4phenylbut3yn1yl)oxy)benzo(56)(14)dioxino(23c)pyridine
78DIBROMO4CHLORO3FLUORO1(4PHENYLBUT3YNOXY)(14)BENZODIOXINO(23C)PYRIDINE
C1=CC=C(C=C1)C#CCCOC2=NC(=C(C3=C2OC4=CC(=C(C=C4O3)Br)Br)Cl)F
InChI=1SC21H11Br2ClFNO3c2213101516(1114(13)23)291918(2815)17(24)20(25)2621(19)279548126213712h13671011H59H2
MFCD03669364
ZINC000001902115
ZINC01902115
ZINC1902115

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Available files

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