Basic information
- CAS
717896-66-7- Standard SMILES
Cc1ccc(C(=O)Nc2ccccc2)cc1S(=O)(=O)Nc1cccc(C)c1C- InChIKey
PORAJPYXAQNKBN-UHFFFAOYSA-N- Molecular formula
- C22H22N2O3S
- Average molar mass
- 394.5 g/mol
Names & identifiers
- Preferred name
- 3-[(2,3-dimethylphenyl)sulfamoyl]-4-methyl-N-phenylbenzamide
- IUPAC
- 3-[(2,3-dimethylphenyl)sulfamoyl]-4-methyl-N-phenylbenzamide
- English name
- 3-[(2,3-dimethylanilino)sulfonyl]-4-methyl-N-phenylbenzamide
- Molecular formula
- C22H22N2O3S
- Molecular weight
- 394.49
Names & synonyms
3-[(2,3-dimethylphenyl)sulfamoyl]-4-methyl-N-phenylbenzamideSTL113538AKOS000377801AO-081/428590813-[(2,3-dimethylanilino)sulfonyl]-4-methyl-N-phenylbenzamide717896-66-7Benzamide, 3-[[(2,3-dimethylphenyl)amino]sulfonyl]-4-methyl-N-phenyl-
Database identifiers
- CAS
717896-66-7
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 83.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 624
Physicochemical properties
- Density
- 1.288 · 1.288±0.06 g/cm3(Predicted)
- pka
- 8.35 · 8.35±0.10(Predicted)
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…