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Home > Pyridines > 650637-98-2
650637-98-2 | 1-(pyridin-2-yl)-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one
CAS No: 650637-98-2 Catalog No: AG01A9XO MDL No:MFCD09901815
Product Description
Catalog Number:
AG01A9XO
Chemical Name:
1-(pyridin-2-yl)-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one
CAS Number:
650637-98-2
Molecular Formula:
C10H7N5O
Molecular Weight:
213.1955
MDL Number:
MFCD09901815
IUPAC Name:
1-pyridin-2-yl-5H-pyrazolo[3,4-d]pyrimidin-4-one
InChI:
InChI=1S/C10H7N5O/c16-10-7-5-14-15(9(7)12-6-13-10)8-3-1-2-4-11-8/h1-6H,(H,12,13,16)
InChI Key:
YWSXVVUGXXPKLW-UHFFFAOYSA-N
SMILES:
O=c1[nH]cnc2c1cnn2c1ccccn1
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.065g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.2g/mol
Monoisotopic Mass:
213.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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