Basic information
- Standard SMILES
COc1cccc(F)c1-c1nc2c([N+](=O)[O-])cccc2n1Cc1c(F)cccc1F- InChIKey
MFTJRRFFRZOZJR-UHFFFAOYSA-N- Molecular formula
- C21H14F3N3O3
- Average molar mass
- 413.3 g/mol
Names & identifiers
- Preferred name
- 1-(2,6-Difluorobenzyl)-2-(2-Fluoro-6-Methoxylphenyl)-4-Nitrobenzimidazole
- IUPAC
- 1-[(2,6-difluorophenyl)methyl]-2-(2-fluoro-6-methoxyphenyl)-4-nitrobenzimidazole
Names & synonyms
SCHEMBL5201720MFTJRRFFRZOZJR-UHFFFAOYSA-N1-(2,6-Difluorobenzyl)-2-(2-Fluoro-6-Methoxylphenyl)-4-Nitrobenzimidazole
Database identifiers
- PubChem CID
- 22482453
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 600
Related reactions
4 records
Compound notes
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