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100548-62-7 | 4H-Pyrazolo[3,4-b]quinolin-4-one, 1,2-dihydro-2,3-dimethyl-
CAS No: 100548-62-7 Catalog No: AG0002B8 MDL No:
Product Description
Catalog Number:
AG0002B8
Chemical Name:
4H-Pyrazolo[3,4-b]quinolin-4-one, 1,2-dihydro-2,3-dimethyl-
CAS Number:
100548-62-7
Molecular Formula:
C12H11N3O
Molecular Weight:
213.2352
IUPAC Name:
2,3-dimethyl-9H-pyrazolo[3,4-b]quinolin-4-one
InChI:
InChI=1S/C12H11N3O/c1-7-10-11(16)8-5-3-4-6-9(8)13-12(10)14-15(7)2/h3-6H,1-2H3,(H,13,14)
InChI Key:
SUFDHAMNARJGAE-UHFFFAOYSA-N
SMILES:
Cn1[nH]c2c(c1C)c(=O)c1c(n2)cccc1
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.24g/mol
Monoisotopic Mass:
213.09g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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