Basic information
- Standard SMILES
Cc1cn([C@@]2(COCc3ccccc3)C[C@H](OC(=S)Oc3ccccc3)[C@@H](CO[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)O2)c(=O)[nH]c1=O- InChIKey
BRHXMGYDNBRCTR-KLBQNTFLSA-N- Molecular formula
- C41H44N2O7SSi
- Average molar mass
- 736.9 g/mol
Names & identifiers
- Preferred name
- Benzyloxymethyl-3'-O-(phenoxythiocarbonyl)-5'-O-tert-butyldiphenylsilylthymidine
- IUPAC
- 1-[(2S,4S,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-phenoxycarbothioyloxy-2-(phenylmethoxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Names & synonyms
BRHXMGYDNBRCTR-KLBQNTFLSA-NBenzyloxymethyl-3'-O-(Phenoxythiocarbonyl)-5'-O-Tert-Butyl-DiphenylsilylthymidineBenzyloxymethyl-3'-O-(phenoxythiocarbonyl)-5'-O-tert-butyldiphenylsilylthymidine
Database identifiers
- PubChem CID
- 131720249
Properties
Computed structural properties
- Topological polar surface area
- 128 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 15
- Heavy atoms
- 52
- Formal charge
- 0
- Complexity
- 1,230
Related reactions
4 records
Compound notes
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