Basic information
- Standard SMILES
COC(=O)c1ccc(S(=O)(=O)NCc2ccc3ccoc3c2)cc1- InChIKey
WCLCUAVQTPTUTA-UHFFFAOYSA-N- Molecular formula
- C17H15NO5S
- Average molar mass
- 345.4 g/mol
Names & identifiers
- Preferred name
- Methyl 4-(N-(benzofuran-6-ylmethyl)sulfamoyl)benzoate
- IUPAC
- methyl 4-(1-benzofuran-6-ylmethylsulfamoyl)benzoate
Names & synonyms
SCHEMBL904699WCLCUAVQTPTUTA-UHFFFAOYSA-NMethyl 4-(N-(benzofuran-6-ylmethyl)sulfamoyl)benzoate
Database identifiers
- PubChem CID
- 66837871
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 94 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 536
Related reactions
3 records
Compound notes
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