Basic information
- Standard SMILES
O=C(O)C(CCc1ccccc1)NS(=O)(=O)c1ccc2oc3ccccc3c2c1- InChIKey
YPOJAHGDLHWILP-UHFFFAOYSA-N- Molecular formula
- C22H19NO5S
- Average molar mass
- 409.5 g/mol
- Monoisotopic mass
- 409.09839388
Names & identifiers
- Preferred name
- 2-(Dibenzofuran-2-ylsulfonylamino)-4-phenylbutanoic acid
- IUPAC
- 2-(dibenzofuran-2-ylsulfonylamino)-4-phenylbutanoic acid
Names & synonyms
SCHEMBL4425599
Database identifiers
- PubChem CID
- 21700746
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 669
Related reactions
1 records
Compound notes
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