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162147-71-9 | 3H-Pyrazolo[3,4-c]isoquinoline, 7,8-dimethoxy-1-methyl-3-phenyl-
CAS No: 162147-71-9 Catalog No: AG001ST2 MDL No:
Product Description
Catalog Number:
AG001ST2
Chemical Name:
3H-Pyrazolo[3,4-c]isoquinoline, 7,8-dimethoxy-1-methyl-3-phenyl-
CAS Number:
162147-71-9
Molecular Formula:
C19H17N3O2
Molecular Weight:
319.3572
IUPAC Name:
7,8-dimethoxy-1-methyl-3-phenylpyrazolo[3,4-c]isoquinoline
InChI:
InChI=1S/C19H17N3O2/c1-12-18-15-10-17(24-3)16(23-2)9-13(15)11-20-19(18)22(21-12)14-7-5-4-6-8-14/h4-11H,1-3H3
InChI Key:
WSUVFNAXJXHUHX-UHFFFAOYSA-N
SMILES:
COc1cc2c(cc1OC)cnc1c2c(C)nn1c1ccccc1
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.132g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.364g/mol
Monoisotopic Mass:
319.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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