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402948-06-5 | 1,7-Naphthyridin-2(1H)-one, 3-(1H-benzimidazol-2-yl)-4-hydroxy-
CAS No: 402948-06-5 Catalog No: AG0073PA MDL No:
Product Description
Catalog Number:
AG0073PA
Chemical Name:
1,7-Naphthyridin-2(1H)-one, 3-(1H-benzimidazol-2-yl)-4-hydroxy-
CAS Number:
402948-06-5
Molecular Formula:
C15H10N4O2
Molecular Weight:
278.2655
IUPAC Name:
3-(1H-benzimidazol-2-yl)-4-hydroxy-1H-1,7-naphthyridin-2-one
InChI:
InChI=1S/C15H10N4O2/c20-13-8-5-6-16-7-11(8)19-15(21)12(13)14-17-9-3-1-2-4-10(9)18-14/h1-7H,(H,17,18)(H2,19,20,21)
InChI Key:
ARRAFPHWAWKGMF-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2cnccc2c(c1c1nc2c([nH]1)cccc2)O
Properties
Complexity:
478
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.08g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
278.271g/mol
Monoisotopic Mass:
278.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
90.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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