7-Methoxy-1,2-dihydroquinoxalin-2-one - CAS 55687-30-4

Catalog:	BB029132
Product Name:	7-Methoxy-1,2-dihydroquinoxalin-2-one
CAS:	55687-30-4
Synonyms:	7-methoxy-1H-quinoxalin-2-one; 7-methoxy-1H-quinoxalin-2-one

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Computed Properties

IUPAC Name:	7-methoxy-1H-quinoxalin-2-one
Description:	7-Methoxy-1,2-dihydroquinoxalin-2-one (CAS# 55687-30-4) is a useful research chemical.
Molecular Weight:	176.17
Molecular Formula:	C9H8N2O2
Canonical SMILES:	COC1=CC2=C(C=C1)N=CC(=O)N2
InChI:	InChI=1S/C9H8N2O2/c1-13-6-2-3-7-8(4-6)11-9(12)5-10-7/h2-5H,1H3,(H,11,12)
InChI Key:	GVERQUMLAYWTMA-UHFFFAOYSA-N
LogP:	0.93170

Publication Number	Title	Priority Date
CA-3060545-A1	Type ii topoisomerase inhibitors and methods of making and using thereof	20170417
EP-3612513-A1	Type ii topoisomerase inhibitors and methods of making and using thereof	20170417
US-2020131158-A1	Type ii topoisomerase inhibitors and methods of making and using thereof	20170417
WO-2018195098-A1	Type ii topoisomerase inhibitors and methods of making and using thereof	20170417
JP-2014156472-A	Quinuclidine compounds as Î±7 nicotinic acetylcholine receptor ligands	20140428

PMID	Publication Date	Title	Journal
11902641	20020101	Synthesis and evaluation for biological activity of 3-alkyl and 3-halogenoalkyl-quinoxalin-2-ones variously substituted. Part 4	Farmaco (Societa chimica italiana : 1989)

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Related Functional Groups

Carbonyl Compounds

[51493-02-8]
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[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
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

Complexity:	240
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	176.058577502
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	176.058577502
Rotatable Bond Count:	1
Topological Polar Surface Area:	50.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8