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65780-60-1 | 2(1H)-Quinoxalinone, 3-(2-benzoxazolyl)-
CAS No: 65780-60-1 Catalog No: AG006OJH MDL No:
Product Description
Catalog Number:
AG006OJH
Chemical Name:
2(1H)-Quinoxalinone, 3-(2-benzoxazolyl)-
CAS Number:
65780-60-1
Molecular Formula:
C15H9N3O2
Molecular Weight:
263.2509
IUPAC Name:
3-(1,3-benzoxazol-2-yl)-1H-quinoxalin-2-one
InChI:
InChI=1S/C15H9N3O2/c19-14-13(16-9-5-1-2-6-10(9)17-14)15-18-11-7-3-4-8-12(11)20-15/h1-8H,(H,17,19)
InChI Key:
TXZUQVOESVNEDL-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2ccccc2nc1c1nc2c(o1)cccc2
Properties
Complexity:
437
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.069g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.256g/mol
Monoisotopic Mass:
263.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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