Basic information
- CAS
22131-38-0- Standard SMILES
O=C1NC(CSSCC2NC(=O)N(c3ccccc3)C2=O)C(=O)N1c1ccccc1- InChIKey
LWWOTFAGDSYYIA-UHFFFAOYSA-N- Molecular formula
- C20H18N4O4S2
- Average molar mass
- 442.5 g/mol
- Monoisotopic mass
- 442.07694742
Names & identifiers
- Preferred name
- 5-[[(2,5-Dioxo-1-phenyl-imidazolidin-4-yl)methyldisulfanyl]methyl]-3-phenyl-imidazolidine-2,4-dione
- IUPAC
- 5-[[(2,5-dioxo-1-phenylimidazolidin-4-yl)methyldisulfanyl]methyl]-3-phenylimidazolidine-2,4-dione
Names & synonyms
NSC405812DTXSID40944772NSC-405812Hydantoin,5'-(thiodimethylene)bis[3-phenyl-Hydantoin,5'-(dithiodimethylene)bis[3-phenyl-2, 5,5'-[dithiobis(methylene)]bis[3-phenyl-Hydantoin, {5,5'-(thiodimethylene)bis[3-phenyl-}Hydantoin, {5,5'-(dithiodimethylene)bis[3-phenyl-}2,4-Imidazolidinedione, 5, {5'-[dithiobis(methylene)]bis[3-phenyl-}5,5'-[Disulfanediylbis(methylene)]bis(2-hydroxy-3-phenyl-3,5-dihydro-4H-imidazol-4-one)5-((((2,5-Dioxo-1-phenyl-4-imidazolidinyl)methyl)dithio)methyl)-3-phenyl-2,4-imidazolidinedione5-[[(2,5-dioxo-1-phenyl-imidazolidin-4-yl)methyldisulfanyl]methyl]-3-phenyl-imidazolidine-2,4-dione
Database identifiers
- CAS
22131-38-0- PubChem CID
- 347256
- DTXSID
DTXSID40944772- Nikkaji
- J49.477A
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 149 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 636
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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