Basic information
- CAS
53458-23-4- Standard SMILES
Nc1nc(Cl)nc2c1ncn2C1OC(CCl)C(O)C1O- InChIKey
SLVRPUYTSVRHEI-UHFFFAOYSA-N- Molecular formula
- C10H11Cl2N5O3
- Average molar mass
- 320.13 g/mol
- Monoisotopic mass
- 319.0238946
Names & identifiers
- Preferred name
- 2-(6-Amino-2-chloropurin-9-yl)-5-(chloromethyl)oxolane-3,4-diol
- IUPAC
- 2-(6-amino-2-chloropurin-9-yl)-5-(chloromethyl)oxolane-3,4-diol
Names & synonyms
53458-23-4NSC166152DTXSID90304529NSC-1661522-Chloro-9-(5-chloro-5-deoxypentofuranosyl)-9H-purin-6-amine
Database identifiers
- CAS
53458-23-4- PubChem CID
- 296233
- DTXSID
DTXSID90304529
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 368
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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