2-(2-bromo-4-methylphenoxy)-N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]acetamide
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Basic information
- CAS
444144-52-9- Standard SMILES
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)COc3ccc(C)cc3Br)cc2)cc1- InChIKey
UBTAOGCKHXWXKM-UHFFFAOYSA-N- Molecular formula
- C23H23BrN2O5S
- Average molar mass
- 519.4 g/mol
Names & identifiers
- Preferred name
- 2-(2-bromo-4-methylphenoxy)-N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]acetamide
- IUPAC
- 2-(2-bromo-4-methylphenoxy)-N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]acetamide
- English name
- 2-(2-bromo-4-methylphenoxy)-N-(4-{[(4-ethoxyphenyl)amino]sulfonyl}phenyl)acetamide
- Molecular formula
- C23H23BrN2O5S
- Molecular weight
- 519.41
Names & synonyms
2-(2-bromo-4-methylphenoxy)-N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]acetamide2-(2-bromo-4-methylphenoxy)-N-{4-[(4-ethoxyanilino)sulfonyl]phenyl}acetamide2-(2-bromo-4-methylphenoxy)-N-{4-[(4-ethoxyphenyl)sulfamoyl]phenyl}acetamideOprea1_355274Oprea1_690542STK083471AKOS000490488AN-329/409230652-(2-bromo-4-methylphenoxy)-N-(4-{[(4-ethoxyphenyl)amino]sulfonyl}phenyl)acetamideAcetamide, 2-(2-bromo-4-methylphenoxy)-N-[4-[[(4-ethoxyphenyl)amino]sulfonyl]phenyl]-
Database identifiers
- CAS
444144-52-9
Properties
Computed structural propertiesFilling in
- XLogP
- 4.7
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 685
Physicochemical properties
- Density
- 1.471 · 1.471±0.06 g/cm3(Predicted)
- pka
- 9.23 · 9.23±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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