Basic information
- CAS
111795-59-6- Standard SMILES
[N-]=[N+]=N[C@@H]1[C@H](O)[C@@H](CO)C[C@H]1n1ccc(N)nc1=O- InChIKey
XSOIFZFGJWIAOQ-MTSNSDSCSA-N- Molecular formula
- C10H14N6O3
- Average molar mass
- 266.26 g/mol
- Monoisotopic mass
- 266.11273833
Names & identifiers
- Preferred name
- 4-amino-1-[(1R,2S,3R,4R)-2-azido-3-hydroxy-4-(hydroxymethyl)cyclopentyl]pyrimidin-2-one
- IUPAC
- 4-amino-1-[(1R,2S,3R,4R)-2-azido-3-hydroxy-4-(hydroxymethyl)cyclopentyl]pyrimidin-2-one
Names & synonyms
4-amino-1-[(1R,2S,3R,4R)-2-azido-3-hydroxy-4-(hydroxymethyl)cyclopentyl]pyrimidin-2-one2(1H)-Pyrimidinone, 4-amino-1-[(1R,2S,3R,4R)-2-azido-3-hydroxy-4-(hydroxymethyl)cyclopentyl]-
Database identifiers
- CAS
111795-59-6- PubChem CID
- 5272147
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 484
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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