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130288-52-7 | 4(3H)-Pyrimidinone, 6-hydroxy-2-[2-(8-hydroxy-7-quinolinyl)diazenyl]-
CAS No: 130288-52-7 Catalog No: AG000U7X MDL No:
Product Description
Catalog Number:
AG000U7X
Chemical Name:
4(3H)-Pyrimidinone, 6-hydroxy-2-[2-(8-hydroxy-7-quinolinyl)diazenyl]-
CAS Number:
130288-52-7
Molecular Formula:
C13H9N5O3
Molecular Weight:
283.2423
IUPAC Name:
4-hydroxy-2-[(8-hydroxyquinolin-7-yl)diazenyl]-1H-pyrimidin-6-one
InChI:
InChI=1S/C13H9N5O3/c19-9-6-10(20)16-13(15-9)18-17-8-4-3-7-2-1-5-14-11(7)12(8)21/h1-6,21H,(H2,15,16,19,20)
InChI Key:
SZNYMTMVVFBKAO-UHFFFAOYSA-N
SMILES:
Oc1cc(=O)[nH]c(n1)N=Nc1ccc2c(c1O)nccc2
Properties
Complexity:
516
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.071g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
283.247g/mol
Monoisotopic Mass:
283.071g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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