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Home > Pyridines > 303752-11-6
303752-11-6 | 7H-Pyrazolo[3,4-c]pyridin-7-one, 1-cyclopentyl-3-ethyl-1,4,5,6-tetrahydro-6-[(4-methoxyphenyl)methyl]-
CAS No: 303752-11-6 Catalog No: AG002ZWD MDL No:
Product Description
Catalog Number:
AG002ZWD
Chemical Name:
7H-Pyrazolo[3,4-c]pyridin-7-one, 1-cyclopentyl-3-ethyl-1,4,5,6-tetrahydro-6-[(4-methoxyphenyl)methyl]-
CAS Number:
303752-11-6
Molecular Formula:
C21H27N3O2
Molecular Weight:
353.4580
IUPAC Name:
1-cyclopentyl-3-ethyl-6-[(4-methoxyphenyl)methyl]-4,5-dihydropyrazolo[3,4-c]pyridin-7-one
InChI:
InChI=1S/C21H27N3O2/c1-3-19-18-12-13-23(14-15-8-10-17(26-2)11-9-15)21(25)20(18)24(22-19)16-6-4-5-7-16/h8-11,16H,3-7,12-14H2,1-2H3
InChI Key:
HGQPCLVBJPSFPH-UHFFFAOYSA-N
SMILES:
CCc1nn(c2c1CCN(C2=O)Cc1ccc(cc1)OC)C1CCCC1
Properties
Complexity:
486
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.21g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
353.466g/mol
Monoisotopic Mass:
353.21g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
47.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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