Basic information
- CAS
57164-73-5- Standard SMILES
CS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc3cc(Cl)ccc23)cc1- InChIKey
IXNKQDSRADETAL-UHFFFAOYSA-N- Molecular formula
- C20H16ClN3O2S
- Average molar mass
- 397.9 g/mol
- Monoisotopic mass
- 397.0651756
Names & identifiers
- Preferred name
- Methanesulfonamide, N-(4-((3-chloro-9-acridinyl)amino)phenyl)-
- IUPAC
- N-[4-[(3-chloroacridin-9-yl)amino]phenyl]methanesulfonamide
Names & synonyms
NIOSH/PB0512090Methanesulfonamide, N-(4-((3-chloro-9-acridinyl)amino)phenyl)-57164-73-5PB051209004'-(3-Chloro-9-acridinylamino)methanesulfonanilideMethanesulfonanilide, 4'-((3-chloro-9-acridinyl)amino)-N-{4-[(3-chloroacridin-9-yl)amino]phenyl}methanesulfonamideCHEMBL9395DTXSID30205804N-(4-((3-Chloro-9-acridinyl)amino)phenyl)methanesulfonamideDB-308939N-[4-[(3-chloro-9-acridinyl)amino]phenyl ]methanesulfonamide
Database identifiers
- CAS
57164-73-5- PubChem CID
- 148796
- DTXSID
DTXSID30205804- ChEMBL
CHEMBL9395- Nikkaji
- J78.399D
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 603
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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