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329731-87-5 | 1,8-Naphthyridin-2(1H)-one,3-[[3-(1,2-dihydro-4-hydroxy-1-methyl-2-oxo-3-quinolinyl)-1,5-dihydro-5-oxo-4H-pyrazol-4-ylidene]methyl]-4-hydroxy-(9CI)
CAS No: 329731-87-5 Catalog No: AG00D4J4 MDL No:
Product Description
Catalog Number:
AG00D4J4
Chemical Name:
1,8-Naphthyridin-2(1H)-one,3-[[3-(1,2-dihydro-4-hydroxy-1-methyl-2-oxo-3-quinolinyl)-1,5-dihydro-5-oxo-4H-pyrazol-4-ylidene]methyl]-4-hydroxy-(9CI)
CAS Number:
329731-87-5
IUPAC Name:
3-[[3-(4-hydroxy-1-methyl-2-oxoquinolin-3-yl)-5-oxo-1,2-dihydropyrazol-4-yl]methylidene]-1H-1,8-naphthyridine-2,4-dione
InChI:
InChI=1S/C22H15N5O5/c1-27-14-7-3-2-5-10(14)18(29)15(22(27)32)16-12(21(31)26-25-16)9-13-17(28)11-6-4-8-23-19(11)24-20(13)30/h2-9,29H,1H3,(H,23,24,30)(H2,25,26,31)
InChI Key:
VUFUXIZSERFUBC-UHFFFAOYSA-N
Properties
Complexity:
1010
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
429.107g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
429.392g/mol
Monoisotopic Mass:
429.107g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
141A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.6
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