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28992-49-6 | Pyridazino[1,6-a]benzimidazol-2(1H)-one
CAS No: 28992-49-6 Catalog No: AG002V5N MDL No:
Product Description
Catalog Number:
AG002V5N
Chemical Name:
Pyridazino[1,6-a]benzimidazol-2(1H)-one
CAS Number:
28992-49-6
Molecular Formula:
C10H7N3O
Molecular Weight:
185.1821
IUPAC Name:
1H-pyridazino[1,6-a]benzimidazol-2-one
InChI:
InChI=1S/C10H7N3O/c14-10-6-5-9-11-7-3-1-2-4-8(7)13(9)12-10/h1-6H,(H,12,14)
InChI Key:
OWMAHCJLPOYEEH-UHFFFAOYSA-N
SMILES:
O=c1ccc2n([nH]1)c1ccccc1n2
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.186g/mol
Monoisotopic Mass:
185.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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