5,6-Difluoro-1-(2,3-di-o-acetyl-5-deoxy-beta-d-ribofuranosyl)-n-(1-methylethyl)1h-benzimidazol-2-amine
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Basic information
- Standard SMILES
CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@@H](C)O[C@H]1n1c(NC(C)C)nc2cc(F)c(F)cc21- InChIKey
MZWMVFMBDVBYTG-BKPUXCOXSA-N- Molecular formula
- C19H23F2N3O5
- Average molar mass
- 411.4 g/mol
Names & identifiers
- Preferred name
- 5,6-Difluoro-1-(2,3-di-o-acetyl-5-deoxy-beta-d-ribofuranosyl)-n-(1-methylethyl)1h-benzimidazol-2-amine
- IUPAC
- [(2R,3R,4R,5R)-4-acetyloxy-5-[5,6-difluoro-2-(propan-2-ylamino)benzimidazol-1-yl]-2-methyloxolan-3-yl] acetate
Names & synonyms
SCHEMBL7740698MZWMVFMBDVBYTG-BKPUXCOXSA-N5,6-difluoro-1-(2,3-di-o-acetyl-5-deoxy-beta-d-ribofuranosyl)-n-(1-methylethyl)1h-benzimidazol-2-amine
Database identifiers
- PubChem CID
- 54099985
Properties
Computed structural propertiesFilling in
- XLogP
- 2.8
- Topological polar surface area
- 91.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 625
Related reactions
1 records
Compound notes
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