Adenosine receptor antagonist 3
2-[(3-methylphenyl)methyl]-6-(1,2-thiazol-3-yl)pyrazolo[3,4-d]pyrimidin-4-amine
Molecular Identity
Adenosine receptor antagonist 3
2-[(3-methylphenyl)methyl]-6-(1,2-thiazol-3-yl)pyrazolo[3,4-d]pyrimidin-4-amine
PubChem CID: 146268692
2D Structure
Properties
C16H14N6S
Molecular Formula
322.40
Molecular Weight
g/mol
322.1001
Exact Mass
Da
2.6
XLogP
Drug-like (Lipinski: < 5)
111
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
6
H-Bond Acceptors
410
Complexity
SMILES
Canonical SMILES
SMILES: CC1=CC(=CC=C1)CN2C=C3C(=NC(=NC3=N2)C4=NSC=C4)NIsomeric SMILES
SMILES: CC1=CC(=CC=C1)CN2C=C3C(=NC(=NC3=N2)C4=NSC=C4)NSynonyms(17)
Adenosine receptor antagonist 32400864-80-2VDV8KB3JJBA2AR Antagonist EXS21546orb1689161SCHEMBL21585828US11786528, Example 1BDBM625944EXS21546EXS-21546MS-24781HY-144419CS-0380173T608722-[(3-methylphenyl)methyl]-6-(1,2-thiazol-3-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-amine
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Adenosine receptor antagonist 3
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