pyrazolo[1,5-a]pyrazin-4-ol - CAS 1301714-00-0

Name: pyrazolo[1,5-a]pyrazin-4-ol
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB057933
Product Name:	pyrazolo[1,5-a]pyrazin-4-ol
CAS:	1301714-00-0
Synonyms:	pyrazolo[1,5-a]pyrazin-4(5h)-one; 4H,5H-pyrazolo[1,5-a]pyrazin-4-one; 5H-pyrazolo[1,5-a]pyrazin-4-one; pyrazolo[1,5-a]pyrazin-4-ol

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Computed Properties

IUPAC Name:	5H-pyrazolo[1,5-a]pyrazin-4-one
Molecular Weight:	135.1
Molecular Formula:	C6H5N3O
Canonical SMILES:	C1=CN2C(=CC=N2)C(=O)N1
InChI:	InChI=1S/C6H5N3O/c10-6-5-1-2-8-9(5)4-3-7-6/h1-4H,(H,7,10)
InChI Key:	YORUZNSCSKMAMN-UHFFFAOYSA-N

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CA-3090150-A1	Ahr modulators	20180206
KR-20200090843-A	6, 7-dihydro pyrazolo[1, 5-a]pyrazinone derivatives and pharmaceutical uses thereof	20171124
CN-108948019-A	Focal adhesion kinase inhibitor and application thereof	20170518
CA-3049136-A1	Substituted pyrazolo[1,5-a]pyrazine compounds as ret kinase inhibitors	20170118
CN-110267960-A	Substituted pyrazolo [1,5-a] pyrazine compound as RET kinase inhibitor	20170118
KR-20180103158-A	Pyrazolo [1,5-a] pyrazin-4-yl derivative	20160224
JP-2018536685-A	Heteroaromatic NMDA receptor modulators and uses thereof	20151209
US-10626122-B2	Heteroaromatic NMDA receptor modulators and uses thereof	20151209
US-2018362541-A1	Heteroaromatic nmda receptor modulators and uses thereof	20151209
US-2021107916-A1	Heteroaromatic nmda receptor modulators and uses thereof	20151209

PMID	Publication Date	Title	Journal
22300067	20120203	Suppressive effects of liquid crystal compounds on the growth of U937 human leukemic monocyte lymphoma cells	Cancer cell international
21733750	20111015	Synthesis, X-ray crystal structure and fluorescent spectra of novel pyrazolo[1,5-a]pyrazin-4(5H)-one derivatives	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy
21640587	20110701	Synthesis of novel pyrazolo[1,5-a]pyrazin-4(5H)-one derivatives and their inhibition against growth of A549 and H322 lung cancer cells	Bioorganic & medicinal chemistry letters
21463913	20110601	Microwave-assisted synthesis, crystal structure of pyrazolo[1,5-a]pyrazin-4(5H)-ones and their selective effects on lung cancer cells	European journal of medicinal chemistry
19013820	20081215	Synthesis and preliminary biological evaluation of novel pyrazolo[1,5-a]pyrazin-4(5H)-one derivatives as potential agents against A549 lung cancer cells	Bioorganic & medicinal chemistry

Complexity:	189
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	135.043261791
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	135.043261791
Rotatable Bond Count:	0
Topological Polar Surface Area:	46.9Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.3