5H-Pyrrolo(1,2-a)imidazole, 2,2'-dithiobis(6,7-dihydro-

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Basic information

CAS: 128366-13-2
Standard SMILES: c1c(SSc2cn3c(n2)CCC3)nc2n1CCC2
InChIKey: ZQQUBNXDJSIART-UHFFFAOYSA-N
Molecular formula: C12H14N4S2
Average molar mass: 278.4 g/mol
Monoisotopic mass: 278.06598881

Names & identifiers

Preferred name: 5H-Pyrrolo(1,2-a)imidazole, 2,2'-dithiobis(6,7-dihydro-
IUPAC: 2-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yldisulfanyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole

Names & synonyms

5H-Pyrrolo(1,2-a)imidazole, 2,2'-dithiobis(6,7-dihydro-128366-13-2Bis(5,6-dihydro-7H-pyrrole(1,2-a)imidazol-2-yl)disulfideDTXSID30155870RefChem:305786DTXCID1078361HMS1578F08STK840259AKOS005625062AB00074798-012,2'-Disulfanediyldi(6,7-dihydro-5H-pyrrolo[1,2-a]imidazole)1,2-bis(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)disulfane

Show more names

2,2'-disulfanediylbis(6,7-dihydro-5H-pyrrolo[1,2-a]imidazole)

Database identifiers

CAS: 128366-13-2
PubChem CID: 787429
DTXSID: DTXSID30155870

Properties

Computed structural properties

XLogP: 1.6
Topological polar surface area: 86.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 18
Formal charge: 0
Complexity: 286

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Compound notes

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