N-[2-chloro-5-[(4-methoxyphenyl)sulfamoyl]phenyl]-2-fluorobenzamide
Basic information
- CAS
380217-38-9- Standard SMILES
COc1ccc(NS(=O)(=O)c2ccc(Cl)c(NC(=O)c3ccccc3F)c2)cc1- InChIKey
BTLAEAKBRCRHOZ-UHFFFAOYSA-N- Molecular formula
- C20H16ClFN2O4S
- Average molar mass
- 434.9 g/mol
- Monoisotopic mass
- 434.050334
Names & identifiers
- Preferred name
- N-[2-chloro-5-[(4-methoxyphenyl)sulfamoyl]phenyl]-2-fluorobenzamide
- IUPAC
- N-[2-chloro-5-[(4-methoxyphenyl)sulfamoyl]phenyl]-2-fluorobenzamide
Names & synonyms
N-[2-chloro-5-[(4-methoxyphenyl)sulfamoyl]phenyl]-2-fluorobenzamideN-{2-chloro-5-[(4-methoxyphenyl)sulfamoyl]phenyl}-2-fluorobenzamideMLS002249609CHEMBL1711903DTXSID501324222HMS3083I05AKOS034180569380217-38-9SMR001317036AB00712200-01Z32120818
Database identifiers
- CAS
380217-38-9- PubChem CID
- 3328255
- DTXSID
DTXSID501324222- ChEMBL
CHEMBL1711903
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 92.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 651
Experimental & physicochemical properties
Solubility2.6 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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