Basic information
- CAS
917598-40-4- Standard SMILES
Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](COC(=O)C3CCCC3)O2)c(=O)[nH]c1=O- InChIKey
QTUOHVJFNVCSQK-YNEHKIRRSA-N- Molecular formula
- C16H21N5O5
- Average molar mass
- 363.37 g/mol
- Monoisotopic mass
- 363.15426879
Names & identifiers
- Preferred name
- [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl cyclopentanecarboxylate
- IUPAC
- [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl cyclopentanecarboxylate
Names & synonyms
917598-40-4[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl cyclopentanecarboxylateCTK3I0263DTXSID804709893'-Azido-5'-O-(cyclopentanecarbonyl)-3'-deoxythymidineCyclopentanecarboxylic acid, 3'-azido-3'-deoxythymidine-5'-yl ester
Database identifiers
- CAS
917598-40-4- PubChem CID
- 11710285
- DTXSID
DTXSID80470989
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 99.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 681
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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