Basic information
- CAS
6613-83-8- Standard SMILES
NS(=O)(=O)c1ccc(CCNC(=O)Cc2cccs2)cc1- InChIKey
DWGJCBRJYFGGNR-UHFFFAOYSA-N- Molecular formula
- C14H16N2O3S2
- Average molar mass
- 324.4 g/mol
- Monoisotopic mass
- 324.06023472
Overview
structure in first source
Names & identifiers
- Preferred name
- N-(2-(4-(aminosulfonyl)phenyl)ethyl)-2-(2-thienyl)acetamide
- IUPAC
- N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylacetamide
Names & synonyms
NAPETA cpdRefChem:926651n-(2-(4-(aminosulfonyl)phenyl)ethyl)-2-(2-thienyl)acetamideN-[2-(4-sulfamoylphenyl)ethyl]-2-(2-thienyl)acetamideN-[2-(4-sulfamoylphenyl)ethyl]-2-(thiophen-2-yl)acetamideN-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylacetamideST044176349537-90-2NAPETAsulfonamide deriv., 5fOprea1_120836Oprea1_814072
Show more names
4-[2-(2-Thienyl)acetamidoethyl]benzenesulfonamideMLS001207920CHEMBL583171BDBM35731DTXSID20350014HMS2823O10N-[2-(4-Sulfamoyl-phenyl)-ethyl]-2-thiophen-2-yl-acetamideEBC-06761
Database identifiers
- CAS
6613-83-8- PubChem CID
- 670786
- DTXSID
DTXSID20350014- ChEMBL
CHEMBL583171- Nikkaji
- J2.556.405G
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 440
Experimental & physicochemical properties
Solubility31.8 [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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