Dimethyl 1-[3,4-dibenzoyloxy-5-(benzoyloxymethyl)oxolan-2-yl]imidazole-4,5-dicarboxylate
Basic information
- CAS
66657-09-8- Standard SMILES
COC(=O)c1ncn(C2OC(COC(=O)c3ccccc3)C(OC(=O)c3ccccc3)C2OC(=O)c2ccccc2)c1C(=O)OC- InChIKey
CKQUEGAZUMRCCX-UHFFFAOYSA-N- Molecular formula
- C33H28N2O11
- Average molar mass
- 628.6 g/mol
- Monoisotopic mass
- 628.16930971
Names & identifiers
- Preferred name
- Dimethyl 1-[3,4-dibenzoyloxy-5-(benzoyloxymethyl)oxolan-2-yl]imidazole-4,5-dicarboxylate
- IUPAC
- dimethyl 1-[3,4-dibenzoyloxy-5-(benzoyloxymethyl)oxolan-2-yl]imidazole-4,5-dicarboxylate
Names & synonyms
NSC36064266657-09-8DTXSID50320523NSC-360642Dimethyl 1-(2,3,5-tri-O-benzoylpentofuranosyl)-1H-imidazole-4,5-dicarboxylate
Database identifiers
- CAS
66657-09-8- PubChem CID
- 338422
- DTXSID
DTXSID50320523
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 159 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 15
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 1,080
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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