Basic information
- Standard SMILES
COc1cc(OC)c(-c2cccs2)cc1C=CC(=O)c1ccc(S(=O)(=O)Nc2cc(C)on2)cc1- InChIKey
IQGABOSRBGJBJJ-UHFFFAOYSA-N- Molecular formula
- C25H22N2O6S2
- Average molar mass
- 510.6 g/mol
- Monoisotopic mass
- 510.09192877
Names & identifiers
- Preferred name
- 4-[3-(2,4-dimethoxy-5-thiophen-2-ylphenyl)prop-2-enoyl]-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
- IUPAC
- 4-[3-(2,4-dimethoxy-5-thiophen-2-ylphenyl)prop-2-enoyl]-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
Names & synonyms
SCHEMBL5564208
Database identifiers
- PubChem CID
- 69488043
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 9
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 839
Related reactions
3 records
Compound notes
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