Basic information
- CAS
91296-11-6- Standard SMILES
Nc1nc(Cl)c2ncn(C3CC(O)C(CO)C3)c2n1- InChIKey
KMURQHWZQUUEGV-UHFFFAOYSA-N- Molecular formula
- C11H14ClN5O2
- Average molar mass
- 283.71 g/mol
- Monoisotopic mass
- 283.0836024
Names & identifiers
- Preferred name
- 4-(2-Amino-6-chloropurin-9-yl)-2-(hydroxymethyl)cyclopentan-1-ol
- IUPAC
- 4-(2-amino-6-chloropurin-9-yl)-2-(hydroxymethyl)cyclopentan-1-ol
Names & synonyms
NSC27563091296-11-6CHEMBL286384SCHEMBL7140801DTXSID50313718NSC-2756304-(2-Amino-6-chloro-9H-purin-9-yl)-2-(hydroxymethyl)cyclopentan-1-ol
Database identifiers
- CAS
91296-11-6- PubChem CID
- 321807
- DTXSID
DTXSID50313718- ChEMBL
CHEMBL286384
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 336
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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