{5-[(4-Chloro-benzyl)-(4-fluoro-benzenesulfonyl)-amino]-2-propyl-benzoimidazol-1-yl}-acetic acid

HCID 11670790
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Basic information

Standard SMILES
CCCc1nc2cc(N(Cc3ccc(Cl)cc3)S(=O)(=O)c3ccc(F)cc3)ccc2n1CC(=O)O
InChIKey
KMHBLHHKOXTMMM-UHFFFAOYSA-N
Molecular formula
C25H23ClFN3O4S
Average molar mass
516 g/mol

Names & identifiers

Preferred name
{5-[(4-Chloro-benzyl)-(4-fluoro-benzenesulfonyl)-amino]-2-propyl-benzoimidazol-1-yl}-acetic acid
IUPAC
2-[5-[(4-chlorophenyl)methyl-(4-fluorophenyl)sulfonylamino]-2-propylbenzimidazol-1-yl]acetic acid

Names & synonyms

SCHEMBL1891626KMHBLHHKOXTMMM-UHFFFAOYSA-N{5-[(4-Chloro-benzyl)-(4-fluoro-benzenesulfonyl)-amino]-2-propyl-benzoimidazol-1-yl}-acetic acid

Database identifiers

PubChem CID
11670790

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
101 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
9
Heavy atoms
35

Related reactions

2 records
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Compound notes

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