Thymidine, 3'-azido-3'-deoxy-, 5'-(hydrogen methylphosphonate)
Basic information
- CAS
124930-62-7- Standard SMILES
Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](COP(C)(=O)O)O2)c(=O)[nH]c1=O- InChIKey
FFVDOSQCTCGNTB-DJLDLDEBSA-N- Molecular formula
- C11H16N5O6P
- Average molar mass
- 345.25 g/mol
- Monoisotopic mass
- 345.08382024
Names & identifiers
- Preferred name
- Thymidine, 3'-azido-3'-deoxy-, 5'-(hydrogen methylphosphonate)
- IUPAC
- [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphinic acid
Names & synonyms
AZT-MePThymidine, 3'-azido-3'-deoxy-, 5'-(hydrogen methylphosphonate)124930-62-73'-Deoxy-3'-azidothymidine-5'-methylphosphonateDTXSID501545223'-Azido-3'-deoxy-5'-O-[hydroxy(methyl)phosphoryl]thymidine[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-methyl-phosphinic acid
Database identifiers
- CAS
124930-62-7- PubChem CID
- 452209
- DTXSID
DTXSID50154522
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 645
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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