Basic information
- Standard SMILES
CN(C)c1nc(N)nc2c1ncn2[C@H]1C[C@H](N=[N+]=[N-])[C@@H](CO)O1- InChIKey
DFJXOUXQJVZGDD-XLPZGREQSA-N- Molecular formula
- C12H17N9O2
- Average molar mass
- 319.32 g/mol
Names & identifiers
- Preferred name
- [(2S,3S,5R)-5-[2-amino-6-(dimethylamino)purin-9-yl]-3-azido-tetrahydrofuran-2-yl]methanol
- IUPAC
- [(2S,3S,5R)-5-[2-amino-6-(dimethylamino)purin-9-yl]-3-azidooxolan-2-yl]methanol
Names & synonyms
CHEMBL602296DFJXOUXQJVZGDD-XLPZGREQSA-N2-Amino-9-(3-azido-2,3-dideoxy-.beta.-D-erythro-pentofuranosyl)-6-dimethylamino-9H-purine2-Amino-9-(3-azido-2,3-dideoxy-beta-D-erythro-pentofuranosyl)-6-dimethylamino-9H-purine[(2S,3S,5R)-5-[2-amino-6-(dimethylamino)purin-9-yl]-3-azido-tetrahydrofuran-2-yl]methanol
Database identifiers
- PubChem CID
- 476457
- ChEMBL
CHEMBL602296- Nikkaji
- J3.022.128A
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 471
Related reactions
1 records
Compound notes
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