Home Aminos 2,4(1H,3H)-Quinazolinedione, 3-amino-

2,4(1H,3H)-Quinazolinedione, 3-amino-

CAS No.:
30386-01-7
Catalog Number:
AG002ZXM
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
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Product Description
Catalog Number:
AG002ZXM
Chemical Name:
2,4(1H,3H)-Quinazolinedione, 3-amino-
CAS Number:
30386-01-7
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
MDL Number:
MFCD00052598
IUPAC Name:
3-amino-1H-quinazoline-2,4-dione
InChI:
InChI=1S/C8H7N3O2/c9-11-7(12)5-3-1-2-4-6(5)10-8(11)13/h1-4H,9H2,(H,10,13)
InChI Key:
NMGODFWGUBLTTA-UHFFFAOYSA-N
SMILES:
Nn1c(=O)[nH]c2c(c1=O)cccc2
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.054g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
177.163g/mol
Monoisotopic Mass:
177.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Literature
Title Journal
Quinolones: action and resistance updated. Current topics in medicinal chemistry 20090801
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Synthesis and antiviral evaluation of some new glycosylthioureas containing a quinazolinone nucleus. Nucleosides, nucleotides & nucleic acids 20020101
Properties