Basic information
- Standard SMILES
CC(Cc1ccccc1)Nc1nc(Cl)nc2c1cnn2-c1ccccc1- InChIKey
BBAWMAAWCQAIFJ-UHFFFAOYSA-N- Molecular formula
- C20H18ClN5
- Average molar mass
- 363.8 g/mol
Names & identifiers
- Preferred name
- 6-chloro-1-phenyl-N-(1-phenylpropan-2-yl)pyrazolo[3,4-d]pyrimidin-4-amine
- IUPAC
- 6-chloro-1-phenyl-N-(1-phenylpropan-2-yl)pyrazolo[3,4-d]pyrimidin-4-amine
Names & synonyms
SCHEMBL8554544
Database identifiers
- PubChem CID
- 20089757
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 438
Related reactions
1 records
Compound notes
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