4-[(5-Methylthiophen-2-yl)methylideneamino]benzenesulfonamide
Basic information
- CAS
5227-19-0- Standard SMILES
Cc1ccc(C=Nc2ccc(S(N)(=O)=O)cc2)s1- InChIKey
VJXFEIUABSKZPB-UHFFFAOYSA-N- Molecular formula
- C12H12N2O2S2
- Average molar mass
- 280.4 g/mol
- Monoisotopic mass
- 280.03401998
Names & identifiers
- Preferred name
- 4-[(5-Methylthiophen-2-yl)methylideneamino]benzenesulfonamide
- IUPAC
- 4-[(5-methylthiophen-2-yl)methylideneamino]benzenesulfonamide
- English name
- 4-{[(5-methyl-2-thienyl)methylene]amino}benzenesulfonamide
- Molecular formula
- C12H12N2O2S2
- Molecular weight
- 280.37
Names & synonyms
5227-19-04-[(5-methylthiophen-2-yl)methylideneamino]benzenesulfonamideDTXSID10352269MFCD00567060STK034766AKOS000485664Cc1ccc(s1)C=Nc1ccc(cc1)S(=O)(=O)NZINC000000125522ST45032253SR-01000199554SR-01000199554-14(((E)(5methylthiophen2yl)methylidene)amino)benzenesulfonamide
Show more names
4-{[(5-methyl-2-thienyl)methylene]amino}benzenesulfonamideBenzenesulfonamide, 4-[[(5-methyl-2-thienyl)methylene]amino]-4-{[(E)-(5-methylthiophen-2-yl)methylidene]amino}benzenesulfonamide
4-[(1E)-2-(5-methyl(2-thienyl))-1-azavinyl]benzenesulfonamide4-{(E)-[(5-Methylthiophen-2-yl)methylidene]amino}benzene-1-sulfonamide
Database identifiers
- CAS
5227-19-0- PubChem CID
- 722069
- DTXSID
DTXSID10352269- Nikkaji
- J1.202.420G
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 395
Physicochemical properties
- Boiling point
- 499.18 · 499.180±55.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.373 · 1.373±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 10.378 · 10.378±0.10(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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