Basic information
- Standard SMILES
COc1cc2c(cc1O)nc(CCC(C)C)n2Cc1ccc(-c2ccccc2C(=O)O)cc1- InChIKey
SZRYAJUASVUICF-UHFFFAOYSA-N- Molecular formula
- C27H28N2O4
- Average molar mass
- 444.5 g/mol
Names & identifiers
- Preferred name
- 4'-[(2-(3-Methylbutyl)-5-hydroxy-6-methoxy-benzimidazol-1-yl)-methyl]biphenyl-2-carboxylic acid
- IUPAC
- 2-[4-[[5-hydroxy-6-methoxy-2-(3-methylbutyl)benzimidazol-1-yl]methyl]phenyl]benzoic acid
Names & synonyms
SCHEMBL8392153SZRYAJUASVUICF-UHFFFAOYSA-N4'-[(2-(3-methylbutyl)-5-hydroxy-6-methoxy-benzimidazol-1-yl)-methyl]biphenyl-2-carboxylic acid
Database identifiers
- PubChem CID
- 15069388
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 84.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 636
Related reactions
2 records
Compound notes
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