Basic information
- CAS
730967-33-6- Standard SMILES
CS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)NC3=NCCS3)c2)cc1- InChIKey
MAOVYVJLWJBLPO-UHFFFAOYSA-N- Molecular formula
- C17H16ClN3O5S3
- Average molar mass
- 474 g/mol
- Monoisotopic mass
- 472.9940618
Names & identifiers
- Preferred name
- 2-chloro-N-(4,5-dihydro-1,3-thiazol-2-yl)-5-[(4-methylsulfonylphenyl)sulfamoyl]benzamide
- IUPAC
- 2-chloro-N-(4,5-dihydro-1,3-thiazol-2-yl)-5-[(4-methylsulfonylphenyl)sulfamoyl]benzamide
Names & synonyms
2-chloro-N-(4,5-dihydro-1,3-thiazol-2-yl)-5-[(4-methylsulfonylphenyl)sulfamoyl]benzamideMLS002157655DTXSID501329622HMS3090B11AKOS034467407730967-33-6SMR001240143Z569448562-Chloro-N-(4,5-dihydro-1,3-thiazol-2-yl)-5-{[4-(methanesulfonyl)phenyl]sulfamoyl}benzamide
Database identifiers
- CAS
730967-33-6- PubChem CID
- 2395545
- DTXSID
DTXSID501329622
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 164 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 843
Experimental & physicochemical properties
Solubility24 [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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