6-Amino-2-(butyloxy)-9-[3-(tetrahydro-3-furanyl)propyl]-7,9-dihydro-8H-purin-8-one
Basic information
- Standard SMILES
CCCCOc1nc(N)c2[nH]c(=O)n(CCCC3CCOC3)c2n1- InChIKey
YWAKIRWCKYOCCA-UHFFFAOYSA-N- Molecular formula
- C16H25N5O3
- Average molar mass
- 335.4 g/mol
Names & identifiers
- Preferred name
- 6-Amino-2-(butyloxy)-9-[3-(tetrahydro-3-furanyl)propyl]-7,9-dihydro-8H-purin-8-one
- IUPAC
- 6-amino-2-butoxy-9-[3-(oxolan-3-yl)propyl]-7H-purin-8-one
Names & synonyms
SCHEMBL2198961YWAKIRWCKYOCCA-UHFFFAOYSA-N6-Amino-2-(butyloxy)-9-[3-(tetrahydro-3-furanyl)propyl]-7,9-dihydro-8H-purin-8-one
Database identifiers
- PubChem CID
- 57699596
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 425
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Related reactions
2 records
Compound notes
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