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Home > Pyridines > 122505-71-9
122505-71-9 | Acetamide, N-(4,5-diphenyl-1H-pyrazolo[3,4-c]pyridazin-3-yl)-
CAS No: 122505-71-9 Catalog No: AG0017BT MDL No:
Product Description
Catalog Number:
AG0017BT
Chemical Name:
Acetamide, N-(4,5-diphenyl-1H-pyrazolo[3,4-c]pyridazin-3-yl)-
CAS Number:
122505-71-9
Molecular Formula:
C19H15N5O
Molecular Weight:
329.3553
IUPAC Name:
N-(4,5-diphenyl-1H-pyrazolo[3,4-c]pyridazin-3-yl)acetamide
InChI:
InChI=1S/C19H15N5O/c1-12(25)20-18-16-15(13-8-4-2-5-9-13)17(14-10-6-3-7-11-14)21-23-19(16)24-22-18/h2-11H,1H3,(H2,20,22,23,24,25)
InChI Key:
PHHUDUOMJNIKIV-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1n[nH]c2c1c(c1ccccc1)c(nn2)c1ccccc1
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.128g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
329.363g/mol
Monoisotopic Mass:
329.128g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Pyrazolo[3,4-c]pyridazines as novel and selective inhibitors of cyclin-dependent kinases. | Journal of medicinal chemistry 20051103 |
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