Basic information
- CAS
477846-82-5- Standard SMILES
O=C(CSc1nnc(-c2ccco2)o1)c1ccc(Cl)cc1- InChIKey
UYKBQYLMKIAXCD-UHFFFAOYSA-N- Molecular formula
- C14H9ClN2O3S
- Average molar mass
- 320.8 g/mol
- Monoisotopic mass
- 320.002241
Names & identifiers
- Preferred name
- 1-(4-Chlorophenyl)-2-{[5-(2-furyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-ethanone
- IUPAC
- 1-(4-chlorophenyl)-2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
- English name
- 1-(4-CHLOROPHENYL)-2-([5-(2-FURYL)-1,3,4-OXADIAZOL-2-YL]SULFANYL)-1-ETHANONE
- Molecular formula
- C14H9ClN2O3S
- Molecular weight
- 320.75
Names & synonyms
477846-82-51-(4-chlorophenyl)-2-{[5-(2-furyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-ethanone1-(4-chlorophenyl)-2-{[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethan-1-one1-(4-chlorophenyl)-2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoneMFCD02186933AKOS00507579310P-1151-(4-Chlorophenyl)-2-((5-(furan-2-yl)-1,3,4-oxadiazol-2-yl)thio)ethan-1-one1-(4-chlorophenyl)-2-[[5-(2-furyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoneEthanone, 1-(4-chlorophenyl)-2-[[5-(2-furanyl)-1,3,4-oxadiazol-2-yl]thio]-1-(4-CHLOROPHENYL)-2-([5-(2-FURYL)-1,3,4-OXADIAZOL-2-YL]SULFANYL)-1-ETHANONE
Database identifiers
- CAS
477846-82-5- PubChem CID
- 1479916
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 94.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 366
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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