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654650-62-1 | 1H-Pyrazolo[4,3-c]quinoline, 4,5-dihydro-1-(4-methoxyphenyl)-3-methyl-
CAS No: 654650-62-1 Catalog No: AG006QQM MDL No:
Product Description
Catalog Number:
AG006QQM
Chemical Name:
1H-Pyrazolo[4,3-c]quinoline, 4,5-dihydro-1-(4-methoxyphenyl)-3-methyl-
CAS Number:
654650-62-1
Molecular Formula:
C18H17N3O
Molecular Weight:
291.3471
IUPAC Name:
1-(4-methoxyphenyl)-3-methyl-4,5-dihydropyrazolo[4,3-c]quinoline
InChI:
InChI=1S/C18H17N3O/c1-12-16-11-19-17-6-4-3-5-15(17)18(16)21(20-12)13-7-9-14(22-2)10-8-13/h3-10,19H,11H2,1-2H3
InChI Key:
BOFJBZKDBMSABE-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)n1nc(c2c1c1ccccc1NC2)C
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.137g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
291.354g/mol
Monoisotopic Mass:
291.137g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
39.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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