C1=NC2=NNC(=C2C(=N1)N)I
CAS: 151266-23-8
Name: 3-iodo-2H-pyrazolo[3,4-d]pyrimidin-4-amine
SMILES: C1=NC2=NNC(=C2C(=N1)N)I

Molecular Processing

Molecular formula
C5H4IN5
Molecular weight
261.03
Exact mass
260.9511
XLogP
0.54
TPSA
80.48
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
48.81

Supplementary Information

InChIKey: HQAIUXZORKJOJY-UHFFFAOYSA-N
Synonyme
151266-23-83-iodo-1H-pyrazolo[3,4-d]pyrimidin-4-amineDTXSID003640583-iodo-1H-pyrazolo(3,4-d)pyrimidin-4-amine3-iodo-1H-pyrazolo{3,4-d}pyrimidin-4-amineRefChem:280018DTXCID80315104688-977-54-Amino-3-iodo-1H-pyrazolo[3,4-d]pyrimidine4-Amino-3-iodopyrazolo[3,4-d]pyrimidine1H-Pyrazolo[3,4-d]pyrimidin-4-amine, 3-iodo-3-iodo-2H-pyrazolo[3,4-d]pyrimidin-4-amine3-Iodo-1H-pyrazolo[3,4-d]pyrimidin-4-ylamineMFCD037879313JLD2YSH4XSCHEMBL8801SCHEMBL975121orb1908383SCHEMBL34201757-iodo-7-deaza-8-aza-adenineCHEMBL6188827SCHEMBL29354524TNU0611HQAIUXZORKJOJY-UHFFFAOYSA-NAKOS015853606CS-W009055EBC-454742FI15351PB15752SB21681
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