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162142-14-5 | 7H-Pyrazolo[3,4-c]pyridin-7-one, 1-cyclopentyl-3-ethyl-1,4,5,6-tetrahydro-
CAS No: 162142-14-5 Catalog No: AG001ST4 MDL No:
Product Description
Catalog Number:
AG001ST4
Chemical Name:
7H-Pyrazolo[3,4-c]pyridin-7-one, 1-cyclopentyl-3-ethyl-1,4,5,6-tetrahydro-
CAS Number:
162142-14-5
Molecular Formula:
C13H19N3O
Molecular Weight:
233.3095
IUPAC Name:
1-cyclopentyl-3-ethyl-5,6-dihydro-4H-pyrazolo[3,4-c]pyridin-7-one
InChI:
InChI=1S/C13H19N3O/c1-2-11-10-7-8-14-13(17)12(10)16(15-11)9-5-3-4-6-9/h9H,2-8H2,1H3,(H,14,17)
InChI Key:
QJLZPHIDOKBEGS-UHFFFAOYSA-N
SMILES:
CCc1nn(c2c1CCNC2=O)C1CCCC1
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.153g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.315g/mol
Monoisotopic Mass:
233.153g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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