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160568-14-9 | 1H-Imidazo[4,5-d]pyridazin-2-amine
CAS No: 160568-14-9 Catalog No: AG001S1B MDL No:
Product Description
Catalog Number:
AG001S1B
Chemical Name:
1H-Imidazo[4,5-d]pyridazin-2-amine
CAS Number:
160568-14-9
Molecular Formula:
C5H5N5
Molecular Weight:
135.1267
IUPAC Name:
1H-imidazo[4,5-d]pyridazin-2-amine
InChI:
InChI=1S/C5H5N5/c6-5-9-3-1-7-8-2-4(3)10-5/h1-2H,(H3,6,9,10)
InChI Key:
BUYBPEINWQQOFV-UHFFFAOYSA-N
SMILES:
Nc1nc2c([nH]1)cnnc2
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.054g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
135.13g/mol
Monoisotopic Mass:
135.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
80.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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