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927825-74-9 | 3-Iodo-6-(methylthio)-1H-pyrazolo[3,4-d]pyrimidine
CAS No: 927825-74-9 Catalog No: AG01FOUZ MDL No:
Product Description
Catalog Number:
AG01FOUZ
Chemical Name:
3-Iodo-6-(methylthio)-1H-pyrazolo[3,4-d]pyrimidine
CAS Number:
927825-74-9
IUPAC Name:
3-iodo-6-methylsulfanyl-2H-pyrazolo[3,4-d]pyrimidine
InChI:
InChI=1S/C6H5IN4S/c1-12-6-8-2-3-4(7)10-11-5(3)9-6/h2H,1H3,(H,8,9,10,11)
InChI Key:
ZGUBRPZJGATADZ-UHFFFAOYSA-N
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.928g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
292.098g/mol
Monoisotopic Mass:
291.928g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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