5-Bromo-4-fluoro-1H-indazole - CAS 1082041-85-7

Catalog:	BB002194
Product Name:	5-Bromo-4-fluoro-1H-indazole
CAS:	1082041-85-7
Synonyms:	5-bromo-4-fluoro-1H-indazole; 5-bromo-4-fluoro-1H-indazole

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	5-bromo-4-fluoro-1H-indazole
Description:	5-Bromo-4-fluoro-1H-indazole (CAS# 1082041-85-7) is a useful research chemical.
Molecular Weight:	215.02
Molecular Formula:	C7H4BrFN2
Canonical SMILES:	C1=CC(=C(C2=C1NN=C2)F)Br
InChI:	InChI=1S/C7H4BrFN2/c8-5-1-2-6-4(7(5)9)3-10-11-6/h1-3H,(H,10,11)
InChI Key:	YJOQUFUSNSCGHN-UHFFFAOYSA-N
LogP:	2.46450

Publication Number	Title	Priority Date
WO-2021149817-A1	Enhancement of anti-tumor activity of SHP2 inhibitor pyrimidinone in combination with novel cancer medicines in cancers	20200124
WO-2021126804-A1	Indazole derivatives and methods of use thereof for the treatment of herpes viruses	20191218
WO-2020022323-A1	Heterobicyclic compounds for inhibiting the activity of shp2	20180724
TW-202019921-A	Heterobicyclic compounds for inhibiting SHP2 activity	20180724
AU-2019309987-A1	Heterobicyclic compounds for inhibiting the activity of shp2	20180724

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Related Functional Groups

Indazoles

[885278-74-0]
Ethyl 1H-Indazole-7-carboxylate
[1956318-62-9]
3-Amino-5-[(3,5-difluorophenyl)difluoromethyl]-1H-indazole
[885520-77-4]
4-Methyl-6-nitro-1H-indazole
[1260381-83-6]
5-Bromo-7-fluoro-1H-indazole
[66607-27-0]
3-Iodo-1H-indazole
[807287-45-2]
3-(Chloromethyl)-4,5,6,7-tetrahydro-1H-indazole

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	155
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	213.95419
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	213.95419
Rotatable Bond Count:	0
Topological Polar Surface Area:	28.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3