1-(3-Azido-3-deoxy-5-O-trityl-beta-D-arabinofuranosyl)thymine

HCID 453031

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Basic information

CAS: 128269-50-1
Standard SMILES: Cc1cn([C@@H]2O[C@H](COC(c3ccccc3)(c3ccccc3)c3ccccc3)[C@@H](N=[N+]=[N-])[C@@H]2O)c(=O)[nH]c1=O
InChIKey: TWNMXQWDAYXXFF-HIQYAUPDSA-N
Molecular formula: C29H27N5O5
Average molar mass: 525.6 g/mol
Monoisotopic mass: 525.20121898

Names & identifiers

Preferred name: 1-(3-Azido-3-deoxy-5-O-trityl-beta-D-arabinofuranosyl)thymine
IUPAC: 1-[(2R,3S,4S,5S)-4-azido-3-hydroxy-5-(trityloxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione

Names & synonyms

3'-Azido-arabino nucleoside1-(3-Azido-3-deoxy-5-O-trityl-beta-D-arabinofuranosyl)thymine128269-50-1DTXSID401558461-(3-Azido-3-deoxy-5-O-trityl-.beta.-D-arabinofuranosyl)thymine1-[(2R,3S,4S,5S)-4-azido-3-hydroxy-5-(trityloxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione1-[3-Azido-3-deoxy-5-O-(triphenylmethyl)-beta-D-arabinofuranosyl]-5-methylpyrimidine-2,4(1H,3H)-dione

Database identifiers

CAS: 128269-50-1
PubChem CID: 453031
DTXSID: DTXSID40155846
Nikkaji: J2.012.518G

Properties

Computed structural properties

XLogP: 4.3
Topological polar surface area: 102 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 7
Rotatable bonds: 8
Heavy atoms: 39
Formal charge: 0
Complexity: 918

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