Home Other Building Blocks 3-AMINO-1,5-DIHYDRO-1-METHYL-4H-PYRAZOLO[3,4-D]PYRIMIDIN-4-ONE

3-AMINO-1,5-DIHYDRO-1-METHYL-4H-PYRAZOLO[3,4-D]PYRIMIDIN-4-ONE

CAS No.:
54738-66-8
Catalog Number:
AG01DSSL
Molecular Formula:
C6H7N5O
Molecular Weight:
165.1527
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Product Description
Catalog Number:
AG01DSSL
Chemical Name:
3-AMINO-1,5-DIHYDRO-1-METHYL-4H-PYRAZOLO[3,4-D]PYRIMIDIN-4-ONE
CAS Number:
54738-66-8
Molecular Formula:
C6H7N5O
Molecular Weight:
165.1527
MDL Number:
MFCD16620155
IUPAC Name:
3-amino-1-methyl-5H-pyrazolo[3,4-d]pyrimidin-4-one
InChI:
InChI=1S/C6H7N5O/c1-11-5-3(4(7)10-11)6(12)9-2-8-5/h2H,1H3,(H2,7,10)(H,8,9,12)
InChI Key:
KTSXHMMOCZUKOW-UHFFFAOYSA-N
SMILES:
Cn1nc(c2c1nc[nH]c2=O)N
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.065g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
165.156g/mol
Monoisotopic Mass:
165.065g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
85.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties