4-[[2-[[2-[(4-Carboxyphenyl)carbamoyl]phenyl]diselanyl]benzoyl]amino]benzoic acid
Basic information
- CAS
148787-82-0- Standard SMILES
O=C(O)c1ccc(NC(=O)c2ccccc2[Se][Se]c2ccccc2C(=O)Nc2ccc(C(=O)O)cc2)cc1- InChIKey
IJFBDAHXGUZYBJ-UHFFFAOYSA-N- Molecular formula
- C28H20N2O6Se2
- Average molar mass
- 638.4 g/mol
- Monoisotopic mass
- 639.96518
Names & identifiers
- Preferred name
- 4-[[2-[[2-[(4-Carboxyphenyl)carbamoyl]phenyl]diselanyl]benzoyl]amino]benzoic acid
- IUPAC
- 4-[[2-[[2-[(4-carboxyphenyl)carbamoyl]phenyl]diselanyl]benzoyl]amino]benzoic acid
Names & synonyms
NSC639781148787-82-04-[[2-[[2-[(4-carboxyphenyl)carbamoyl]phenyl]diselanyl]benzoyl]amino]benzoic acidCHEMBL3972396DTXSID30327257NSC-6397814,4'-[Diselane-1,2-diylbis(2,1-phenylenecarbonylazanediyl)]dibenzoic acid4-((2-(2-(2-((4-Carboxyanilino)carbonyl)phenyl)diselanyl)benzoyl)amino)benzoic acid
Database identifiers
- CAS
148787-82-0- PubChem CID
- 368663
- DTXSID
DTXSID30327257- ChEMBL
CHEMBL3972396- Nikkaji
- J770.405D
Properties
Computed structural properties
- Topological polar surface area
- 133 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 773
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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