Basic information
- CAS
74038-05-4- Standard SMILES
C1CSC(=[N+]2CC[N+](=C3SCCS3)CC2)S1- InChIKey
RTMVVRIQWDAVLG-UHFFFAOYSA-N- Molecular formula
- C10H16N2S4+2
- Average molar mass
- 292.5 g/mol
- Monoisotopic mass
- 292.01963321
Names & identifiers
- Preferred name
- 1,4-Bis(1,3-dithiolan-2-ylidene)piperazine-1,4-diium
- IUPAC
- 1,4-bis(1,3-dithiolan-2-ylidene)piperazine-1,4-diium
Names & synonyms
NSC191956Piperazinium, 1,4-bis(1,3-dithiolan-2-ylidene)-, dibromide1,4-bis(1,3-dithiolan-2-ylidene)piperazine-1,4-diiumCHEMBL2008171NCI60_001610{N,N'-Bis[2-(1,3-dithiolanylidene)]piperazinium} dibromidePiperazinium, {N,N'-bis[2-(1,3-dithiolanylidene)]-,} dibromide1,4-Di(1,3-dithiolan-2-ylidene)-1.lambda.~5~,4.lambda.~5~-piperazine
Database identifiers
- CAS
74038-05-4- PubChem CID
- 198564
- ChEMBL
CHEMBL2008171
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 2
- Complexity
- 289
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…