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314274-91-4 | 1H-Pyrazolo[3,4-b]quinoline, 1-methyl-3,4-diphenyl-
CAS No: 314274-91-4 Catalog No: AG007JFR MDL No:
Product Description
Catalog Number:
AG007JFR
Chemical Name:
1H-Pyrazolo[3,4-b]quinoline, 1-methyl-3,4-diphenyl-
CAS Number:
314274-91-4
Molecular Formula:
C23H17N3
Molecular Weight:
335.4012
IUPAC Name:
1-methyl-3,4-diphenylpyrazolo[3,4-b]quinoline
InChI:
InChI=1S/C23H17N3/c1-26-23-21(22(25-26)17-12-6-3-7-13-17)20(16-10-4-2-5-11-16)18-14-8-9-15-19(18)24-23/h2-15H,1H3
InChI Key:
VNNPYBNWCDHBDF-UHFFFAOYSA-N
SMILES:
Cn1nc(c2c1nc1ccccc1c2c1ccccc1)c1ccccc1
Properties
Complexity:
468
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.142g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
335.41g/mol
Monoisotopic Mass:
335.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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