5-Bromo-N-(3-cyanophenyl)-2-ethoxybenzene-1-sulfonamide
Basic information
- CAS
5444-96-2- Standard SMILES
CCOc1ccc(Br)cc1S(=O)(=O)Nc1cccc(C#N)c1- InChIKey
MAOJRIIULGLDMQ-UHFFFAOYSA-N- Molecular formula
- C15H13BrN2O3S
- Average molar mass
- 381.2 g/mol
- Monoisotopic mass
- 379.98303
Names & identifiers
- Preferred name
- 5-Bromo-N-(3-cyanophenyl)-2-ethoxybenzene-1-sulfonamide
- IUPAC
- 5-bromo-N-(3-cyanophenyl)-2-ethoxybenzenesulfonamide
Names & synonyms
5444-96-2DTXSID80368817AKOS008010993Z45702505T0519-67485-Bromo-N-(3-cyanophenyl)-2-ethoxybenzene-1-sulfonamide
Database identifiers
- CAS
5444-96-2- PubChem CID
- 2493532
- DTXSID
DTXSID80368817
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 87.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 511
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Compound notes
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