Basic information
- CAS
53793-01-4- Standard SMILES
NS(=O)(=O)c1ccc(N=Nc2c(O)n(-c3ccccc3)n(-c3ccccc3)c2=O)cc1- InChIKey
VPIKSYIFHUWAEG-UHFFFAOYSA-N- Molecular formula
- C21H17N5O4S
- Average molar mass
- 435.5 g/mol
- Monoisotopic mass
- 435.10012521
Names & identifiers
- Preferred name
- 4-(N'-(3,5-Dioxo-1,2-diphenylpyrazolidin-4-ylidene)hydrazino)benzenesulfonamide
- IUPAC
- 4-[(3-hydroxy-5-oxo-1,2-diphenylpyrazol-4-yl)diazenyl]benzenesulfonamide
Names & synonyms
53793-01-4NSC279281NSC 2792814-(N'-(3,5-Dioxo-1,2-diphenylpyrazolidin-4-ylidene)hydrazino)benzenesulfonamideCHEMBL4358914-[N'-(3,5-Dioxo-1,2-diphenylpyrazolidin-4-ylidene)hydrazino]benzenesulfonamideDTXSID30202075BDBM50056815NSC-2792814-[2-(3,5-Dioxo-1,2-diphenyl-4-pyrazolidinylidene)hydrazino]benzenesulfonamide4-[2-(3,5-dioxo-1,2-diphenyl-pyrazolidin-4-ylidene)hydrazino]benzenesulfonamide4-[2-(3,5-Dioxo-1,2-diphenylpyrazolidin-4-ylidene)hydrazin-1-yl]benzene-1-sulfonamide
Show more names
4-[N''-(3,5-Dioxo-1,2-diphenyl-pyrazolidin-4-ylidene)-hydrazino]-benzenesulfonamide
Database identifiers
- CAS
53793-01-4- PubChem CID
- 322334
- DTXSID
DTXSID30202075- ChEMBL
CHEMBL435891
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 137 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 817
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…