Basic information
- Standard SMILES
Cn1ccc(-c2nc3cc(Oc4ccccc4F)c(Oc4ccc(S(C)(=O)=O)nc4)cc3[nH]2)n1- InChIKey
LOJDOARKWXBTNQ-UHFFFAOYSA-N- Molecular formula
- C23H18FN5O4S
- Average molar mass
- 479.5 g/mol
- Monoisotopic mass
- 479.10635341
Names & identifiers
- Preferred name
- 5-(2-Fluoro-phenoxy)-2-(1-methyl-1H-pyrazol-3-yl)-6-(6-methanesulfonyl-pyridin-3-yloxy)-1H-benzimidazole
- IUPAC
- 5-(2-fluorophenoxy)-2-(1-methylpyrazol-3-yl)-6-[(6-methylsulfonyl-3-pyridinyl)oxy]-1H-benzimidazole
Names & synonyms
SCHEMBL2645166LOJDOARKWXBTNQ-UHFFFAOYSA-N5-(2-Fluoro-phenoxy)-2-(1-methyl-1H-pyrazol-3-yl)-6-(6-methanesulfonyl-pyridin-3-yloxy)-1H-benzimidazole
Database identifiers
- PubChem CID
- 135697992
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 801
Related reactions
1 records
Compound notes
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