9-[3,4-dimethoxy-5-(methoxymethyl)oxolan-2-yl]-N-methylpurin-6-amine
Basic information
- CAS
65649-47-0- Standard SMILES
CNc1ncnc2c1ncn2C1OC(COC)C(OC)C1OC- InChIKey
YWYRKAVKCNCVON-UHFFFAOYSA-N- Molecular formula
- C14H21N5O4
- Average molar mass
- 323.35 g/mol
- Monoisotopic mass
- 323.15935417
Names & identifiers
- Preferred name
- 9-[3,4-dimethoxy-5-(methoxymethyl)oxolan-2-yl]-N-methylpurin-6-amine
- IUPAC
- 9-[3,4-dimethoxy-5-(methoxymethyl)oxolan-2-yl]-N-methylpurin-6-amine
Names & synonyms
65649-47-0NSC2460789-[3,4-dimethoxy-5-(methoxymethyl)oxolan-2-yl]-N-methylpurin-6-amineDTXSID70311857NSC-246078N-Methyl-9-(2,3,5-tri-O-methylpentofuranosyl)-9H-purin-6-amine
Database identifiers
- CAS
65649-47-0- PubChem CID
- 316992
- DTXSID
DTXSID70311857
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 92.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 390
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Compound notes
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