Basic information
- Standard SMILES
CCOC(=O)CC(NS(=O)(=O)c1cccc(-c2cccc(N)c2)c1)c1ccccc1- InChIKey
LGMGGTAIHSSTEG-UHFFFAOYSA-N- Molecular formula
- C23H24N2O4S
- Average molar mass
- 424.5 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-{[(3'-amino[1,1'-biphenyl]-3-yl)sulfonyl]amino}-3-phenyl-propanoate
- IUPAC
- ethyl 3-[[3-(3-aminophenyl)phenyl]sulfonylamino]-3-phenylpropanoate
Names & synonyms
SCHEMBL5878081LGMGGTAIHSSTEG-UHFFFAOYSA-Nethyl 3-{[(3'-amino[1,1'-biphenyl]-3-yl)sulfonyl]amino}-3-phenyl-propanoate
Database identifiers
- PubChem CID
- 21982473
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 642
Related reactions
3 records
Compound notes
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