Basic information
- Standard SMILES
CC(C)n1nc(-c2ccc(F)c(O)c2)c2c(N)ncnc21- InChIKey
CJMMCIXRPVLDBH-UHFFFAOYSA-N- Molecular formula
- C14H14FN5O
- Average molar mass
- 287.29 g/mol
Names & identifiers
- Preferred name
- 5-(4-amino-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl)-2-fluorophenol
- IUPAC
- 5-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-2-fluorophenol
Names & synonyms
5-(4-amino-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl)-2-fluorophenolSCHEMBL3607753CHEMBL1242377CJMMCIXRPVLDBH-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 24905280
- ChEMBL
CHEMBL1242377
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 89.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 371
Related reactions
3 records
Compound notes
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