Basic information
- CAS
438235-92-8- Standard SMILES
CC(=O)c1ccc(N2CCN(C(=O)c3cc(Br)c(Br)s3)CC2)cc1- InChIKey
CRYJTSIMEWLANC-UHFFFAOYSA-N- Molecular formula
- C17H16Br2N2O2S
- Average molar mass
- 472.2 g/mol
- Monoisotopic mass
- 469.92992
Names & identifiers
- Preferred name
- 1-[4-[4-[(4,5-Dibromo-2-thienyl)carbonyl]-1-piperazinyl]phenyl]ethanone
- IUPAC
- 1-[4-[4-(4,5-dibromothiophene-2-carbonyl)piperazin-1-yl]phenyl]ethanone
Names & synonyms
438235-92-81-[4-[4-[(4,5-Dibromo-2-thienyl)carbonyl]-1-piperazinyl]phenyl]ethanone1-(4-{4-[(4,5-dibromo-2-thienyl)carbonyl]-1-piperazinyl}phenyl)ethanone1-(4-(4-((4,5-Dibromo-2-thienyl)carbonyl)-1-piperazinyl)phenyl)ethanoneRefChem:2247101-[4-[4-(4,5-dibromothiophene-2-carbonyl)piperazin-1-yl]phenyl]ethanoneDTXSID801153066STK4498501-(4-{4-[(4,5-dibromothiophen-2-yl)carbonyl]piperazin-1-yl}phenyl)ethanoneAKOS001395741ST50832335AK-968/41923959
Show more names
1-acetyl-4-{4-[(4,5-dibromo(2-thienyl))carbonyl]piperazinyl}benzene1-{4-[4-(4,5-Dibromothiophene-2-carbonyl)piperazin-1-yl]phenyl}ethan-1-one
Database identifiers
- CAS
438235-92-8- PubChem CID
- 999338
- DTXSID
DTXSID801153066
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 68.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 477
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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