Basic information
- Standard SMILES
Fc1ccc(Cn2c(NC3CCN(CCc4ccccn4)CC3)nc3cncnc32)cc1- InChIKey
UKHRTZJRVFTLEV-UHFFFAOYSA-N- Molecular formula
- C24H26FN7
- Average molar mass
- 431.5 g/mol
Names & identifiers
- Preferred name
- 9-[(4-fluorophenyl)methyl]-N-[1-[2-(2-pyridinyl)ethyl]-4-piperidinyl]-9H-purin-8-amine
- IUPAC
- 9-[(4-fluorophenyl)methyl]-N-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]purin-8-amine
Names & synonyms
SCHEMBL9564929UKHRTZJRVFTLEV-UHFFFAOYSA-N9-[(4-fluorophenyl)methyl]-N-[1-[2-(2-pyridinyl)ethyl]-4-piperidinyl]-9H-purin-8-amine
Database identifiers
- PubChem CID
- 19785316
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 71.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 565
Related reactions
3 records
Compound notes
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