N,N-diethyl-3-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide
Basic information
- CAS
578745-16-1- Standard SMILES
CCN(CC)S(=O)(=O)c1cccc(-c2csc(C)n2)c1- InChIKey
XEQDTORROYRUMD-UHFFFAOYSA-N- Molecular formula
- C14H18N2O2S2
- Average molar mass
- 310.4 g/mol
- Monoisotopic mass
- 310.08097017
Names & identifiers
- Preferred name
- N,N-diethyl-3-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide
- IUPAC
- N,N-diethyl-3-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide
Names & synonyms
N,N-diethyl-3-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide578745-16-1MLS000778478CHEMBL1708210SCHEMBL19627019DTXSID001323005HMS2773G16HMS5166G03STK904631AKOS002785032SMR000415272AF-399/42490332
Show more names
N,N-diethyl-3-(2-methylthiazol-4-yl)benzenesulfonamideN,N-Diethyl-3-(2-methyl-thiazol-4-yl)-benzenesulfonamideN,N-DIETHYL-3-(2-METHYL-1,3-THIAZOL-4-YL)BENZENE-1-SULFONAMIDE
Database identifiers
- CAS
578745-16-1- PubChem CID
- 829863
- DTXSID
DTXSID001323005- ChEMBL
CHEMBL1708210
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 86.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 404
Experimental & physicochemical properties
Solubility37.8 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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