Basic information
- CAS
57164-79-1- Standard SMILES
COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2cc(Br)ccc12- InChIKey
OMWDRBUUMHVGEL-UHFFFAOYSA-N- Molecular formula
- C21H18BrN3O3S
- Average molar mass
- 472.4 g/mol
- Monoisotopic mass
- 471.02523
Names & identifiers
- Preferred name
- Methanesulfonanilide, 4'-((3-bromo-9-acridinyl)amino)-3'-methoxy-
- IUPAC
- N-[4-[(3-bromoacridin-9-yl)amino]-3-methoxyphenyl]methanesulfonamide
Names & synonyms
SN 16507BRN 0459896Methanesulfonanilide, 4'-((3-bromo-9-acridinyl)amino)-3'-methoxy-57164-79-1Methanesulfon-m-anisidide, 4'-((3-bromo-9-acridinyl)amino)-4'-((3-Bromo-9-acridinyl)amino)-3'-methoxymethanesulfonanilideDTXSID502058065-22-11-00042 (Beilstein Handbook Reference)Methanesulfonamide, N-(4-((3-bromo-9-acridinyl)amino)-3-methoxyphenyl)-RefChem:352298DTXCID40128297CHEMBL9851
Show more names
N-{4-[(3-bromoacridin-9-yl)amino]-3-methoxyphenyl}methanesulfonamide
Database identifiers
- CAS
57164-79-1- PubChem CID
- 148798
- DTXSID
DTXSID50205806- ChEMBL
CHEMBL9851- Nikkaji
- J85.391G
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 88.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 658
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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