Basic information
- Standard SMILES
COC(=O)c1cccc(Cn2c(-c3ccc(Cl)cc3OC)nc3cc(F)c(F)cc32)c1- InChIKey
PUYVMDMJTLHJQA-UHFFFAOYSA-N- Molecular formula
- C23H17ClF2N2O3
- Average molar mass
- 442.8 g/mol
Names & identifiers
- Preferred name
- 3-[2-(4-Chloro-2-methoxy-phenyl)-5,6-difluoro-benzoimidazol-1-ylmethyl]-benzoic acid methyl ester
- IUPAC
- methyl 3-[[2-(4-chloro-2-methoxyphenyl)-5,6-difluorobenzimidazol-1-yl]methyl]benzoate
Names & synonyms
SCHEMBL1483030PUYVMDMJTLHJQA-UHFFFAOYSA-N3-[2-(4-Chloro-2-methoxy-phenyl)-5,6-difluoro-benzoimidazol-1-ylmethyl]-benzoic acid methyl ester
Database identifiers
- PubChem CID
- 67050102
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 630
Related reactions
1 records
Compound notes
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