N-(4-Methylphenyl)-N-(thianthren-2-yl)benzenesulfonamide
Basic information
- CAS
116752-57-9- Standard SMILES
Cc1ccc(N(c2ccc3c(c2)Sc2ccccc2S3)S(=O)(=O)c2ccccc2)cc1- InChIKey
YNKOECZJRARWMB-UHFFFAOYSA-N- Molecular formula
- C25H19NO2S3
- Average molar mass
- 461.6 g/mol
- Monoisotopic mass
- 461.05779237
Names & identifiers
- Preferred name
- N-(4-Methylphenyl)-N-(thianthren-2-yl)benzenesulfonamide
- IUPAC
- N-(4-methylphenyl)-N-thianthren-2-ylbenzenesulfonamide
Names & synonyms
DTXSID601201132Benzenesulfonamide, N-(4-methylphenyl)-N-2-thianthrenyl-N-(4-Methylphenyl)-N-(thianthren-2-yl)benzenesulfonamide116752-57-9
Database identifiers
- CAS
116752-57-9- PubChem CID
- 85565587
- DTXSID
DTXSID601201132
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 96.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 694
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…