AZddF-ribofuranosyl-T

HCID 453033

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Basic information

CAS: 132776-25-1
Standard SMILES: Cc1cn([C@@H]2O[C@H](COC(c3ccccc3)(c3ccccc3)c3ccccc3)[C@@H](N=[N+]=[N-])[C@H]2F)c(=O)[nH]c1=O
InChIKey: ROMMFHSLNJIJCT-DLGLWYJGSA-N
Molecular formula: C29H26FN5O4
Average molar mass: 527.5 g/mol
Monoisotopic mass: 527.19688249

Names & identifiers

Preferred name: AZddF-ribofuranosyl-T
IUPAC: 1-[(2R,3R,4R,5S)-4-azido-3-fluoro-5-(trityloxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione

Names & synonyms

AZddF-ribofuranosyl-T132776-25-11-(3-Azido-2,3-dideoxy-2-fluoro-beta-D-ribofuranosyl)thymineDTXSID401577843'-Azido-3'-deoxy-2'-fluoro-5'-O-(triphenylmethyl)thymidine1-(3-Azido-2,3-dideoxy-2-fluoro-.beta.-D-ribofuranosyl)thymine1-[(2R,3R,4R,5S)-4-azido-3-fluoro-5-(trityloxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione

Database identifiers

CAS: 132776-25-1
PubChem CID: 453033
DTXSID: DTXSID40157784

Properties

Computed structural properties

XLogP: 5.3
Topological polar surface area: 82.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 7
Rotatable bonds: 8
Heavy atoms: 39
Formal charge: 0
Complexity: 921

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