Basic information
- CAS
21413-25-2- Standard SMILES
CCC1(c2ccccc2)C(=O)NC(=O)N1S(=O)(=O)c1ccccc1- InChIKey
HWWVPVUGOLNSEB-UHFFFAOYSA-N- Molecular formula
- C17H16N2O4S
- Average molar mass
- 344.4 g/mol
- Monoisotopic mass
- 344.08307817
Names & identifiers
- Preferred name
- 1-Benzenesulfonyl-5-ethyl-5-phenylhydantoin
- IUPAC
- 1-(benzenesulfonyl)-5-ethyl-5-phenylimidazolidine-2,4-dione
- English name
- 1-benzenesulfonyl-5-ethyl-5-phenylhydantoin
- Molecular formula
- C17H16N2O4S
- Molecular weight
- 344.38
Names & synonyms
BSEPH1-Benzenesulfonyl-5-ethyl-5-phenylhydantoin21413-25-2RefChem:9074991-(benzenesulfonyl)-5-ethyl-5-phenylimidazolidine-2,4-dioneDTXSID408749092,4-Imidazolidinedione, 5-ethyl-5-phenyl-1-(phenylsulfonyl)-
Database identifiers
- CAS
21413-25-2- PubChem CID
- 89498
- DTXSID
DTXSID40874909- Nikkaji
- J1.605.944G
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 91.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 601
Experimental & physicochemical properties
LogP2.44
Physicochemical properties
- Density
- 1.292 · 1.2920 (rough estimate)
- refractive index
- 1.693 · 1.6930 (estimate)
- Water Solubility
- 336.9 mg/L · 336.9mg/L(37 ºC)
Chemistry & industry
Suppliers1 total
合肥孚亚生物技术有限公司18096409024 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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