Basic information
- Standard SMILES
Nc1ncnc2c1cnn2-c1ccc(NS(=O)(=O)c2cccs2)cc1- InChIKey
SFNLWBPAIACZIN-UHFFFAOYSA-N- Molecular formula
- C15H12N6O2S2
- Average molar mass
- 372.4 g/mol
- Monoisotopic mass
- 372.04631599
Names & identifiers
- Preferred name
- Thiophene-2-sulfonic Acid [4-(4-amino-pyrazolo[3,4-d]pyrimidin-1-yl)-phenyl]-amide
- IUPAC
- N-[4-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]thiophene-2-sulfonamide
Names & synonyms
SCHEMBL13790443SFNLWBPAIACZIN-UHFFFAOYSA-NThiophene-2-sulfonic Acid [4-(4-amino-pyrazolo[3,4-d]pyrimidin-1-yl)-phenyl]-amide
Database identifiers
- PubChem CID
- 11996552
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 152 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 563
Related reactions
2 records
Compound notes
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