Basic information
- Standard SMILES
CCCc1nc2cc(N(Cc3cccc(Cl)c3Cl)S(=O)(=O)c3ccc(F)cc3)ccc2n1CC(=O)O- InChIKey
XDRVBZUCAYCZDI-UHFFFAOYSA-N- Molecular formula
- C25H22Cl2FN3O4S
- Average molar mass
- 550.4 g/mol
Names & identifiers
- Preferred name
- {5-[(2,3-Dichloro-benzyl)-(4-fluoro-benzenesulfonyl)-amino]-2-propyl-benzoimidazol-1-yl}-acetic acid
- IUPAC
- 2-[5-[(2,3-dichlorophenyl)methyl-(4-fluorophenyl)sulfonylamino]-2-propylbenzimidazol-1-yl]acetic acid
Names & synonyms
SCHEMBL1887747XDRVBZUCAYCZDI-UHFFFAOYSA-N{5-[(2,3-Dichloro-benzyl)-(4-fluoro-benzenesulfonyl)-amino]-2-propyl-benzoimidazol-1-yl}-acetic acid
Database identifiers
- PubChem CID
- 11548477
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 855
Related reactions
2 records
Compound notes
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