4-Bromo-1-cyclopropyl-1H-pyrazole - CAS 1151802-23-1

Catalog:	BB003501
Product Name:	4-Bromo-1-cyclopropyl-1H-pyrazole
CAS:	1151802-23-1
Synonyms:	4-bromo-1-cyclopropylpyrazole; 4-bromo-1-cyclopropylpyrazole

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-bromo-1-cyclopropylpyrazole
Description:	4-Bromo-1-cyclopropyl-1H-pyrazole (CAS# 1151802-23-1) is used in the treatment of cancer as a triazolopyridazine c-Met kinase inhibitor.
Molecular Weight:	187.04
Molecular Formula:	C6H7BrN2
Canonical SMILES:	C1CC1N2C=C(C=N2)Br
InChI:	InChI=1S/C6H7BrN2/c7-5-3-8-9(4-5)6-1-2-6/h3-4,6H,1-2H2
InChI Key:	PCWRBBLXAOCSQC-UHFFFAOYSA-N
Storage:	Sealed in dry, 2-8 °C
LogP:	1.98050

Publication Number	Title	Priority Date
WO-2021080929-A1	N-(heteroaryl) quinazolin-2-amine derivatives as lrrk2 inhibitors, pharmaceutical compositions, and uses thereof	20191025
CN-112457295-A	Compound with Axl and c-Met kinase inhibitory activity and preparation and application thereof	20190906
WO-2021043217-A1	Compound having axl and c-met kinase inhibitory activity, preparation thereof and application thereof	20190906
US-2020377510-A1	Derivatives of piperlongumine and uses thereof	20190530
WO-2020112706-A1	7-, 8-, and 10-SUBSTITUTED AMINO TRIAZOLO QUINAZOLINE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITIONS AND THEIR USE	20181130

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Related Functional Groups

Pyrazoles

[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[51355-91-0]
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]
1-(Chloromethyl)-3-nitro-1H-pyrazole
[514801-07-1]
3-[(4-Chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde

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

Complexity:	114
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	185.97926
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	185.97926
Rotatable Bond Count:	1
Topological Polar Surface Area:	17.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4