3-Bromo-N-[5-(diethylsulfamoyl)-2-(morpholin-4-yl)phenyl]benzene-1-carboximidic acid
Basic information
- CAS
5584-48-5- Standard SMILES
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)c2cccc(Br)c2)c1- InChIKey
GDZJGQKNJDTEJZ-UHFFFAOYSA-N- Molecular formula
- C21H26BrN3O4S
- Average molar mass
- 496.4 g/mol
- Monoisotopic mass
- 495.08274
Names & identifiers
- Preferred name
- 3-Bromo-N-[5-(diethylsulfamoyl)-2-(morpholin-4-yl)phenyl]benzene-1-carboximidic acid
- IUPAC
- 3-bromo-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]benzamide
Names & synonyms
5584-48-5DTXSID40971240AKOS0339671703-Bromo-N-[5-(diethylsulfamoyl)-2-(morpholin-4-yl)phenyl]benzene-1-carboximidic acidZ26535487
Database identifiers
- CAS
5584-48-5- PubChem CID
- 5205221
- DTXSID
DTXSID40971240
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 87.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 662
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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