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100644-67-5

100644-67-5 | 1H-Pyrazolo[3,4-d]pyrimidin-6-amine, 4-methoxy-

CAS No: 100644-67-5 Catalog No: AG0002K6 MDL No:MFCD09264064

Product Description

Catalog Number:
AG0002K6
Chemical Name:
1H-Pyrazolo[3,4-d]pyrimidin-6-amine, 4-methoxy-
CAS Number:
100644-67-5
Molecular Formula:
C6H7N5O
Molecular Weight:
165.1527
MDL Number:
MFCD09264064
IUPAC Name:
4-methoxy-1H-pyrazolo[3,4-d]pyrimidin-6-amine
InChI:
InChI=1S/C6H7N5O/c1-12-5-3-2-8-11-4(3)9-6(7)10-5/h2H,1H3,(H3,7,8,9,10,11)
InChI Key:
JGSDDGDWMGPLPH-UHFFFAOYSA-N
SMILES:
COc1nc(N)nc2c1cn[nH]2

Properties

Complexity:
166  
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:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
165.156g/mol
Monoisotopic Mass:
165.065g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
89.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  

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