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Home > Imidazoles > 152534-26-4
152534-26-4 | 1-Heptanone,7-[2-(1H-imidazol-1-yl)-5-methylimidazo[1,5-b]pyridazin-7-yl]-1-phenyl-
CAS No: 152534-26-4 Catalog No: AG006U1Y MDL No:
Product Description
Catalog Number:
AG006U1Y
Chemical Name:
1-Heptanone,7-[2-(1H-imidazol-1-yl)-5-methylimidazo[1,5-b]pyridazin-7-yl]-1-phenyl-
CAS Number:
152534-26-4
Molecular Formula:
C23H25N5O
Molecular Weight:
387.4775
IUPAC Name:
7-(2-imidazol-1-yl-5-methylimidazo[1,5-b]pyridazin-7-yl)-1-phenylheptan-1-one
InChI:
InChI=1S/C23H25N5O/c1-18-20-13-14-23(27-16-15-24-17-27)26-28(20)22(25-18)12-8-3-2-7-11-21(29)19-9-5-4-6-10-19/h4-6,9-10,13-17H,2-3,7-8,11-12H2,1H3
InChI Key:
IOUDUHWREIAEKP-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)CCCCCCc1nc(c2n1nc(cc2)n1ccnc1)C
Properties
Complexity:
523
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
387.206g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
387.487g/mol
Monoisotopic Mass:
387.206g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
65.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
Literature
| Title | Journal |
|---|---|
| Synthesis and anti-HIV-1 activity of a series of imidazo[1,5-b]pyridazines. | Journal of medicinal chemistry 19931126 |
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