Basic information
- Standard SMILES
CCOC[C@H]1O[C@@H](n2cnc3c(Cl)nc(Cl)nc32)[C@H](OC(C)=O)[C@@H]1OC(C)=O- InChIKey
JZEWBHNSEBJZJS-SDBHATRESA-N- Molecular formula
- C16H18Cl2N4O6
- Average molar mass
- 433.2 g/mol
Names & identifiers
- Preferred name
- 2,6-dichloro-9-(2,3-di-O-acetyl-5-O-ethyl-beta-D-ribofuranosyl)-purine
- IUPAC
- [(2R,3R,4R,5R)-4-acetyloxy-5-(2,6-dichloropurin-9-yl)-2-(ethoxymethyl)oxolan-3-yl] acetate
Names & synonyms
SCHEMBL5351514JZEWBHNSEBJZJS-SDBHATRESA-N2,6-dichloro-9-(2,3-di-O-acetyl-5-O-ethyl-beta-D-ribofuranosyl)-purine
Database identifiers
- PubChem CID
- 11070082
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 587
Related reactions
2 records
Compound notes
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