Basic information
- Standard SMILES
COc1cc(C(C)n2cnc3cc(-c4ccc(F)cc4)ccc32)ccc1OCc1ccc(C(F)(F)F)nc1- InChIKey
VDEKULFJRYJXEM-UHFFFAOYSA-N- Molecular formula
- C29H23F4N3O2
- Average molar mass
- 521.5 g/mol
Names & identifiers
- Preferred name
- 5-(4-fluorophenyl)-1-(1-(3-methoxy-4-((6-(trifluoromethyl)pyridin-3-yl)methoxy)phenyl)ethyl)-1H-benzo[d]imidazole
- IUPAC
- 5-(4-fluorophenyl)-1-[1-[3-methoxy-4-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]phenyl]ethyl]benzimidazole
Names & synonyms
5-(4-fluorophenyl)-1-(1-(3-methoxy-4-((6-(trifluoromethyl)pyridin-3-yl)methoxy)phenyl)ethyl)-1H-benzo[d]imidazoleCHEMBL3678294SCHEMBL16763305SCHEMBL29774357BDBM164952US9067914, Ex. 3-47
Database identifiers
- PubChem CID
- 118009837
- ChEMBL
CHEMBL3678294
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 49.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 750
Related reactions
2 records
Compound notes
Loading…