Basic information
- CAS
443729-68-8- Standard SMILES
O=C1CSC(c2cccc(Br)c2)N1- InChIKey
CZWBHFIMZHWZNS-UHFFFAOYSA-N- Molecular formula
- C9H8BrNOS
- Average molar mass
- 258.14 g/mol
- Monoisotopic mass
- 256.951
Names & identifiers
- Preferred name
- 2-(3-Bromophenyl)-1,3-thiazolidin-4-one
- IUPAC
- 2-(3-bromophenyl)-1,3-thiazolidin-4-one
Names & synonyms
2-(3-bromophenyl)-1,3-thiazolidin-4-one443729-68-82-(3-bromophenyl)-4-thiazolidinoneSCHEMBL8096935DTXSID401296430STA005847STK099750AKOS005396348DB-3404734-THIAZOLIDINONE, 2-(3-BROMOPHENYL)-
Database identifiers
- CAS
443729-68-8- PubChem CID
- 3900489
- DTXSID
DTXSID401296430
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 212
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…