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Home > Pyridines > 909187-64-0
909187-64-0 | 6-benzyl-2,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-3-one
CAS No: 909187-64-0 Catalog No: AG00IGCN MDL No:MFCD11521565
Product Description
Catalog Number:
AG00IGCN
Chemical Name:
6-benzyl-2,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-3-one
CAS Number:
909187-64-0
Molecular Formula:
C13H15N3O
Molecular Weight:
229.2777
MDL Number:
MFCD11521565
IUPAC Name:
6-benzyl-2,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-3-one
InChI:
InChI=1S/C13H15N3O/c17-13-11-6-7-16(9-12(11)14-15-13)8-10-4-2-1-3-5-10/h1-5H,6-9H2,(H2,14,15,17)
InChI Key:
XDDWGECWOBJRNT-UHFFFAOYSA-N
SMILES:
O=c1[nH][nH]c2c1CCN(C2)Cc1ccccc1
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.122g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
229.283g/mol
Monoisotopic Mass:
229.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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