Basic information
- Standard SMILES
CCC1=Nc2nc(C3CCCC3)[nH]c2C2=NC(Cc3ccccc3)CN12- InChIKey
MSFHYKUQLMQQJG-UHFFFAOYSA-N- Molecular formula
- C21H25N5
- Average molar mass
- 347.5 g/mol
- Monoisotopic mass
- 347.21099582
Names & identifiers
- IUPAC
- 8-benzyl-2-cyclopentyl-5-ethyl-7,8-dihydro-1H-imidazo[2,1-f]purine
Database identifiers
- PubChem CID
- 22239920
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 56.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 573
Related reactions
1 records
Compound notes
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