3-[6-(Dimethylamino)purin-9-yl]-5-(hydroxymethyl)cyclopentane-1,2-diol;hydrochloride
Basic information
- CAS
49815-25-0- Standard SMILES
CN(C)c1ncnc2c1ncn2C1CC(CO)C(O)C1O.Cl- InChIKey
GUZNQRYAQUNPJP-UHFFFAOYSA-N- Molecular formula
- C13H20ClN5O3
- Average molar mass
- 329.78 g/mol
- Monoisotopic mass
- 329.1254672
Names & identifiers
- Preferred name
- 3-[6-(Dimethylamino)purin-9-yl]-5-(hydroxymethyl)cyclopentane-1,2-diol;hydrochloride
- IUPAC
- 3-[6-(dimethylamino)purin-9-yl]-5-(hydroxymethyl)cyclopentane-1,2-diol;hydrochloride
Names & synonyms
49815-25-0DTXSID40712473NSC136508NSC-136508DS-0045933-(6-dimethylaminopurin-9-yl)-5-(hydroxymethyl)cyclopentane-1,2-diol3-[6-(Dimethylamino)-9H-purin-9-yl]-5-(hydroxymethyl)cyclopentane-1,2-diol--hydrogen chloride (1/1)
Database identifiers
- CAS
49815-25-0- PubChem CID
- 54598477
- DTXSID
DTXSID40712473
Properties
Computed structural properties
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 372
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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