3-(2-Amino-6-chloropurin-9-yl)-5-(hydroxymethyl)cyclopentane-1,2-diol
Basic information
- CAS
88852-57-7- Standard SMILES
Nc1nc(Cl)c2ncn(C3CC(CO)C(O)C3O)c2n1- InChIKey
YPNCGBSKCXEJKT-UHFFFAOYSA-N- Molecular formula
- C11H14ClN5O3
- Average molar mass
- 299.71 g/mol
- Monoisotopic mass
- 299.078517
Names & identifiers
- Preferred name
- 3-(2-Amino-6-chloropurin-9-yl)-5-(hydroxymethyl)cyclopentane-1,2-diol
- IUPAC
- 3-(2-amino-6-chloropurin-9-yl)-5-(hydroxymethyl)cyclopentane-1,2-diol
Names & synonyms
NSC613816CHEMBL278297NSC166562NSC-166562NSC-613816
Database identifiers
- CAS
88852-57-7- PubChem CID
- 296415
- ChEMBL
CHEMBL278297
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 365
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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