Benzenesulfonamide, p-(2,5-dimethylpyrrol-1-yl)-
Basic information
- CAS
26165-69-5- Standard SMILES
Cc1ccc(C)n1-c1ccc(S(N)(=O)=O)cc1- InChIKey
STHWURXTZRCILS-UHFFFAOYSA-N- Molecular formula
- C12H14N2O2S
- Average molar mass
- 250.32 g/mol
- Monoisotopic mass
- 250.07759887
Names & identifiers
- Preferred name
- Benzenesulfonamide, p-(2,5-dimethylpyrrol-1-yl)-
- IUPAC
- 4-(2,5-dimethylpyrrol-1-yl)benzenesulfonamide
- English name
- 4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenesulfonamide
- Molecular formula
- C12H14N2O2S
- Molecular weight
- 250.31676
Names & synonyms
26165-69-5Benzenesulfonamide, p-(2,5-dimethylpyrrol-1-yl)-p-(2,5-Dimethylpyrrol-1-yl)benzenesulfonamideDTXSID00180790RefChem:325491DTXCID401032814-(2,5-dimethylpyrrol-1-yl)benzenesulfonamide4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenesulfonamideBenzenesulfonamide,4-(2,5-dimethyl-1H-pyrrol-1-yl)-Maybridge3_002377Cambridge id 6979348Oprea1_245529
Show more names
OSM-A-5CHEMBL442458SCHEMBL21225813HMS1437M01CCG-42774EBC-12753STK196869AKOS000328535
Database identifiers
- CAS
26165-69-5- PubChem CID
- 213325
- DTXSID
DTXSID00180790- ChEMBL
CHEMBL442458
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 73.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 345
Related reactions
0 records
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Compound notes
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