Basic information
- CAS
142356-42-1- Standard SMILES
CC(=O)OC[C@H]1O[C@@H](n2c(Br)nc3cc(Cl)c(Cl)cc32)[C@H](OC(C)=O)[C@@H]1OC(C)=O- InChIKey
YOHBOWGRGQAKAT-QBPKDAKJSA-N- Molecular formula
- C18H17BrCl2N2O7
- Average molar mass
- 524.1 g/mol
Names & identifiers
- Preferred name
- [(2R,3R,4R,5R)-3,4-diacetoxy-5-(2-bromo-5,6-dichloro-benzimidazol-1-yl)tetrahydrofuran-2-yl]methyl acetate
- IUPAC
- [(2R,3R,4R,5R)-3,4-diacetyloxy-5-(2-bromo-5,6-dichlorobenzimidazol-1-yl)oxolan-2-yl]methyl acetate
Names & synonyms
[(2R,3R,4R,5R)-3,4-diacetoxy-5-(2-bromo-5,6-dichloro-benzimidazol-1-yl)tetrahydrofuran-2-yl]methyl acetateEN7YFG6JRHSCHEMBL3545846CHEMBL3143098YOHBOWGRGQAKAT-QBPKDAKJSA-N[(2R,3R,4R,5R)-3,4-bis(acetyloxy)-5-(2-bromo-5,6-dichloro-1H-1,3-benzodiazol-1-yl)oxolan-2-yl]methyl acetate2-Bromo-5,6-dichloro-1-.beta.-D-ribofuranosylbenzimidazole, triacetate1H-Benzimidazole, 2-bromo-5,6-dichloro-1-(2,3,5-tri-O-acetyl-beta-D-ribofuranosyl)-2-Bromo-5,6-dichloro-1-(2,3,5-tri-O-acetyl-beta-D-ribofuranosyl)-1H-benzimidazole2-Bromo-5,6-dichloro-1-(2,3,5-tri-O-acetyl-beta-D-ribofuranosyl)benzimidazole142356-42-1
Database identifiers
- CAS
142356-42-1- PubChem CID
- 466020
- ChEMBL
CHEMBL3143098- UNII
- EN7YFG6JRH
- Nikkaji
- J718.537E
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 687
Related reactions
13 records
Compound notes
Loading…