2,6-Dibromo-4-fluorobenzothiazole - CAS 1188226-62-1

Catalog:	BB004305
Product Name:	2,6-Dibromo-4-fluorobenzothiazole
CAS:	1188226-62-1
Synonyms:	2,6-dibromo-4-fluoro-1,3-benzothiazole; 2,6-dibromo-4-fluoro-1,3-benzothiazole

Technical Data

Patents

Computed Properties

IUPAC Name:	2,6-dibromo-4-fluoro-1,3-benzothiazole
Description:	2,6-Dibromo-4-fluorobenzothiazole (CAS# 1188226-62-1 ) is a useful research chemical.
Molecular Weight:	310.97
Molecular Formula:	C7H2Br2FNS
Canonical SMILES:	C1=C(C=C(C2=C1SC(=N2)Br)F)Br
InChI:	InChI=1S/C7H2Br2FNS/c8-3-1-4(10)6-5(2-3)12-7(9)11-6/h1-2H
InChI Key:	DJCDJILEBWTXIQ-UHFFFAOYSA-N
LogP:	3.96040

Publication Number	Title	Priority Date
WO-2021161216-A1	Farnesoid x receptor modulating compounds and methods of using the same	20200211
WO-2020033382-A1	Compounds useful in modulating the farnesoid x receptor and methods of making and using the same	20180808
AU-2019319750-A1	Compounds useful in modulating the farnesoid X receptor and methods of making and using the same	20180808
CA-3106033-A1	Compounds useful in modulating the farnesoid x receptor and methods of making and using the same	20180808
EP-3833434-A1	Compounds useful in modulating the farnesoid x receptor and methods of making and using the same	20180808

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Complexity:	183
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	310.82382
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	308.82587
Rotatable Bond Count:	0
Topological Polar Surface Area:	41.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4.2