N-[1-[4,5-bis(dimethylamino)naphthalen-1-yl]-2,2,2-trichloroethyl]-4-chlorobenzenesulfonamide
Basic information
- CAS
5484-60-6- Standard SMILES
CN(C)c1cccc2c(C(NS(=O)(=O)c3ccc(Cl)cc3)C(Cl)(Cl)Cl)ccc(N(C)C)c12- InChIKey
HKYMMZCXSJOGMF-UHFFFAOYSA-N- Molecular formula
- C22H23Cl4N3O2S
- Average molar mass
- 535.3 g/mol
- Monoisotopic mass
- 533.026509
Names & identifiers
- Preferred name
- N-[1-[4,5-bis(dimethylamino)naphthalen-1-yl]-2,2,2-trichloroethyl]-4-chlorobenzenesulfonamide
- IUPAC
- N-[1-[4,5-bis(dimethylamino)naphthalen-1-yl]-2,2,2-trichloroethyl]-4-chlorobenzenesulfonamide
Names & synonyms
5484-60-6N-[1-[4,5-bis(dimethylamino)naphthalen-1-yl]-2,2,2-trichloroethyl]-4-chlorobenzenesulfonamideN-{1-[4,5-bis(dimethylamino)-1-naphthyl]-2,2,2-trichloroethyl}-4-chlorobenzenesulfonamideN-{1-[4,5-BIS(DIMETHYLAMINO)NAPHTHALEN-1-YL]-2,2,2-TRICHLOROETHYL}-4-CHLOROBENZENE-1-SULFONAMIDEN-{1-[4,5-bis(dimethylamino)naphthalen-1-yl]-2,2,2-trichloroethyl}-4-chlorobenzenesulfonamideDTXSID20385927STK674329AKOS001766311AG-205/12762458AG-690/11664130
Database identifiers
- CAS
5484-60-6- PubChem CID
- 2848822
- DTXSID
DTXSID20385927- Nikkaji
- J911.590K
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 61 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 718
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Related reactions
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Compound notes
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