Basic information
- CAS
6156-46-3- Standard SMILES
O=C1C(=Cc2c(Cl)cccc2Cl)SC(=S)N1c1cccc(Br)c1- InChIKey
PJIDYQRAUUZFAN-UHFFFAOYSA-N- Molecular formula
- C16H8BrCl2NOS2
- Average molar mass
- 445.2 g/mol
- Monoisotopic mass
- 442.86077
Names & identifiers
- Preferred name
- 3-(3-Bromophenyl)-5-[(2,6-dichlorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
- IUPAC
- 3-(3-bromophenyl)-5-[(2,6-dichlorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Names & synonyms
6156-46-33-(3-bromophenyl)-5-[(2,6-dichlorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-oneDTXSID40977141
Database identifiers
- CAS
6156-46-3- PubChem CID
- 5227791
- DTXSID
DTXSID40977141
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 77.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 520
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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