Basic information
- CAS
2190-85-4- Standard SMILES
O=C1NC(=O)C(CSCc2ccccc2)(c2ccccc2)N1- InChIKey
CRQFXOWMFLWHCR-UHFFFAOYSA-N- Molecular formula
- C17H16N2O2S
- Average molar mass
- 312.4 g/mol
- Monoisotopic mass
- 312.09324893
Names & identifiers
- Preferred name
- Hydantoin, 5-((benzylthio)methyl)-5-phenyl-
- IUPAC
- 5-(benzylsulfanylmethyl)-5-phenylimidazolidine-2,4-dione
Names & synonyms
BRN 02970515-((Benzylthio)methyl)-5-phenylhydantoinHYDANTOIN, 5-((BENZYLTHIO)METHYL)-5-PHENYL-2190-85-44-25-00-00328 (Beilstein Handbook Reference)RefChem:347956DTXSID409444994-[(Benzylsulfanyl)methyl]-4-phenyl-4H-imidazole-2,5-diol
Database identifiers
- CAS
2190-85-4- PubChem CID
- 16609
- DTXSID
DTXSID40944499
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 83.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 417
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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