Basic information
- CAS
57164-61-1- Standard SMILES
Nc1ccc(S(=O)(=O)Nc2ccc(Nc3c4ccccc4nc4ccccc34)cc2)cc1- InChIKey
VJNNPHQBMGZVQG-UHFFFAOYSA-N- Molecular formula
- C25H20N4O2S
- Average molar mass
- 440.5 g/mol
- Monoisotopic mass
- 440.13069707
Names & identifiers
- Preferred name
- Sulfanilanilide, 4'-(9-acridinylamino)-
- IUPAC
- N-[4-(acridin-9-ylamino)phenyl]-4-aminobenzenesulfonamide
- English name
- N-[4-[(Acridine-9-yl)amino]phenyl]-4-aminobenzenesulfonamide
- Molecular formula
- C25H20N4O2S
- Molecular weight
- 440.52
Names & synonyms
Sulfanilanilide, 4'-(9-acridinylamino)-57164-91-7DTXSID40205810RefChem:1099175DTXCID7012830157164-61-14'-(9-Acridinylamino)sulfanilanilideBRN 0460107CHEMBL48441Sulfanilanilide, monohydrochlorideNSC140701N-{4-[(ACRIDIN-9-YL)AMINO]PHENYL}-4-AMINOBENZENE-1-SULFONAMIDE
Show more names
4-Amino-N-[4-(9-acridinylamino)phenyl]benzenesulfonamideBenzenesulfonamide, N-[4-(9-acridinylamino)phenyl]-4-amino-N-[4-[(Acridine-9-yl)amino]phenyl]-4-aminobenzenesulfonamide
NSC-140701DB-3089414'-(9-ACRIDINYLAMINO)SULFANILANILIDE, MONOHYDROCHLORIDEN-[4-[(acridine-9-yl)amino]phenyl ]-4-aminobenzenesulfonamide
Database identifiers
- CAS
57164-61-1、57164-91-7- PubChem CID
- 148802
- DTXSID
DTXSID40205810- ChEMBL
CHEMBL48441- Nikkaji
- J90.651D
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 688
Physicochemical properties
- EWG's Food Scores
- 1 · 1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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