Basic information
- Standard SMILES
CC(C)(C)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2C(Cl)c2ccncc2)cc1- InChIKey
RTAKYAWBHHWWIT-UHFFFAOYSA-N- Molecular formula
- C22H22Cl2N2O2S
- Average molar mass
- 449.4 g/mol
- Monoisotopic mass
- 448.0779045
Names & identifiers
- Preferred name
- 4-tert-Butyl-N-[4-chloro-2-(chloro-pyridin-4-yl-methyl)-phenyl]-benzenesulfonamide
- IUPAC
- 4-tert-butyl-N-[4-chloro-2-[chloro(pyridin-4-yl)methyl]phenyl]benzenesulfonamide
Names & synonyms
SCHEMBL1630066RTAKYAWBHHWWIT-UHFFFAOYSA-N4-tert-Butyl-N-[4-chloro-2-(chloro-pyridin-4-yl-methyl)-phenyl]-benzenesulfonamide
Database identifiers
- PubChem CID
- 59485502
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 618
Related reactions
3 records
Compound notes
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