7-Nitroquinazolin-4(3H)-one - CAS 20872-93-9

Catalog:	BB016366
Product Name:	7-Nitroquinazolin-4(3H)-one
CAS:	20872-93-9
Synonyms:	7-nitro-3H-quinazolin-4-one; 7-nitro-3H-quinazolin-4-one

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	7-nitro-3H-quinazolin-4-one
Description:	7-Nitroquinazolin-4(3H)-one (CAS# 20872-93-9) is a useful research chemical.
Molecular Weight:	191.14
Molecular Formula:	C8H5N3O3
Canonical SMILES:	C1=CC2=C(C=C1[N+](=O)[O-])N=CNC2=O
InChI:	InChI=1S/C8H5N3O3/c12-8-6-2-1-5(11(13)14)3-7(6)9-4-10-8/h1-4H,(H,9,10,12)
InChI Key:	LPCJURLBTXOJHS-UHFFFAOYSA-N
Boiling Point:	381.3 °C at 760 mmHg
Density:	1.64 g/cm³
LogP:	1.35450

Publication Number	Title	Priority Date
KR-102063286-B1	Novel Hydroxamic Acid Incorporating Quinazolin-4(3H)-ones as Histone Deacetylase Inhibitors and Anticancer Composition Comprising the Same	20180525
KR-20190134180-A	Novel Hydroxamic Acid Incorporating Quinazolin-4(3H)-ones as Histone Deacetylase Inhibitors and Anticancer Composition Comprising the Same	20180525
EP-3570836-A1	2-arylsulfonamido-n-arylacetamide derivatized stat3 inhibitors	20170123
JP-2020505457-A	2-Arylsulfonamide-N-arylacetamide derivatized Stat3	20170123
US-2019389844-A1	2-arylsulfonamido-n-arylacetamide derivatized stat3 inhibitors	20170123

PMID	Publication Date	Title	Journal
22365563	20120401	Synthesis and SAR optimization of quinazolin-4(3H)-ones as poly(ADP-ribose)polymerase-1 inhibitors	European journal of medicinal chemistry
21201454	20080111	7-Nitro-quinazolin-4(3H)-one	Acta crystallographica. Section E, Structure reports online

Related Products

Online Inquiry

Name:

* Phone:

* Service & Products of Interested:

Project Description:

* Quantity:

* Email:

* Verification Code:

Customer Support

If the product you need is not in our catalog, please contact us in time to submit your needs. You can help our website get better and better. Why not submit the request today?

Submit Requirement

Customer Centered

Global Delivery

Warehouses in multiple cities to ensure fast delivery

Quality Assurance

Strict process parameter control to ensure product quality

Large Stock

> 20,000 building blocks and intermediates from stock

Process Scale-up

Process scale-up from lab to industrial scale

Flexible Batch Size

Flexible batch size for diverse industrial demands

Related Functional Groups

Nitrogen Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[1243387-55-4]
1-Cyclopropoxy-3-nitro-5-(trifluoromethyl)benzene
[78056-67-4]
2-(1-Benzyl-4-piperidyl)acetonitrile

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, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	297
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	191.03309103
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	191.03309103
Rotatable Bond Count:	0
Topological Polar Surface Area:	87.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.5