4-[(3-Chloro-1,4-dioxonaphthalen-2-yl)amino]benzenesulfonamide
Basic information
- CAS
6949-34-4- Standard SMILES
NS(=O)(=O)c1ccc(NC2=C(Cl)C(=O)c3ccccc3C2=O)cc1- InChIKey
ZCSWBRADQTXXKX-UHFFFAOYSA-N- Molecular formula
- C16H11ClN2O4S
- Average molar mass
- 362.8 g/mol
- Monoisotopic mass
- 362.0128057
Names & identifiers
- Preferred name
- 4-[(3-Chloro-1,4-dioxonaphthalen-2-yl)amino]benzenesulfonamide
- IUPAC
- 4-[(3-chloro-1,4-dioxonaphthalen-2-yl)amino]benzenesulfonamide
Names & synonyms
6949-34-4NSC453814-[(3-chloro-1,4-dioxonaphthalen-2-yl)amino]benzenesulfonamide4-[(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]benzenesulfonamideSCHEMBL2240870DTXSID30286395NSC-453814-[(3-chloro-1,4-dioxo-2-naphthyl)amino]benzenesulfonamide4-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]benzene-1-sulfonamide
Database identifiers
- CAS
6949-34-4- PubChem CID
- 239793
- DTXSID
DTXSID30286395
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 675
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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