200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 28682-94-2
28682-94-2 | 4H-Imidazo[4,5-d]pyridazin-4-one, 3,5-dihydro-
CAS No: 28682-94-2 Catalog No: AG002W2F MDL No:MFCD11557171
Product Description
Catalog Number:
AG002W2F
Chemical Name:
4H-Imidazo[4,5-d]pyridazin-4-one, 3,5-dihydro-
CAS Number:
28682-94-2
Molecular Formula:
C5H4N4O
Molecular Weight:
136.1115
MDL Number:
MFCD11557171
IUPAC Name:
3,6-dihydroimidazo[4,5-d]pyridazin-7-one
InChI:
InChI=1S/C5H4N4O/c10-5-4-3(1-8-9-5)6-2-7-4/h1-2H,(H,6,7)(H,9,10)
InChI Key:
DSZCQHJBMSIMNX-UHFFFAOYSA-N
SMILES:
O=c1[nH]ncc2c1[nH]cn2
NSC Number:
19452
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.039g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
136.114g/mol
Monoisotopic Mass:
136.039g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
Literature
| Title | Journal |
|---|---|
| Structure-activity relationships for the binding of ligands to xanthine or guanine phosphoribosyl-transferase from Toxoplasma gondii. | Biochemical pharmacology 19951109 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.