Basic information
- CAS
150012-67-2- Standard SMILES
CC1=C(N2CCN(C3=C(C)N([O-])ON3)CC2)NON1[O-]- InChIKey
VJBKELHGNACFOC-UHFFFAOYSA-N- Molecular formula
- C10H16N6O4-2
- Average molar mass
- 284.27 g/mol
- Monoisotopic mass
- 284.12330301
Names & identifiers
- Preferred name
- Piperazine, 1,4-bis(methylfurazanyl)-, N(sup 1),N(sup 4)-dioxide
- IUPAC
- 4-methyl-3-[4-(4-methyl-5-oxido-2H-1,2,5-oxadiazol-3-yl)piperazin-1-yl]-5-oxido-2H-1,2,5-oxadiazole
Names & synonyms
Piperazine, 1,4-bis(methylfurazanyl)-, N(sup 1),N(sup 4)-dioxide150012-67-21,4-Bis(methylfurazanyl)piperazine N(sup 1),N(sup 4)-dioxideN,N'-Bis(3-methyl-2-oxo-1,2,5-oxadiazol-4-yl)piperazineDTXSID80164452RefChem:371739DTXCID80869434,4'-(Piperazine-1,4-diyl)bis(3-methyl-1,2,5-oxadiazol-2(5H)-olate)
Database identifiers
- CAS
150012-67-2- PubChem CID
- 3073571
- DTXSID
DTXSID80164452
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- -2
- Complexity
- 417
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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