2,2'-Disulfanediylbis(4,6-diphenylpyridine-3,5-dicarbonitrile)
Basic information
- CAS
86625-34-5- Standard SMILES
N#Cc1c(SSc2nc(-c3ccccc3)c(C#N)c(-c3ccccc3)c2C#N)nc(-c2ccccc2)c(C#N)c1-c1ccccc1- InChIKey
LQKBOAIBKUZEGT-UHFFFAOYSA-N- Molecular formula
- C38H20N6S2
- Average molar mass
- 624.7 g/mol
- Monoisotopic mass
- 624.11908701
Names & identifiers
- Preferred name
- 2,2'-Disulfanediylbis(4,6-diphenylpyridine-3,5-dicarbonitrile)
- IUPAC
- 2-[(3,5-dicyano-4,6-diphenyl-2-pyridinyl)disulfanyl]-4,6-diphenylpyridine-3,5-dicarbonitrile
Names & synonyms
86625-34-5DTXSID905139572,2'-Disulfanediylbis(4,6-diphenylpyridine-3,5-dicarbonitrile)
Database identifiers
- CAS
86625-34-5- PubChem CID
- 12957482
- DTXSID
DTXSID90513957
Properties
Computed structural properties
- XLogP
- 8
- Topological polar surface area
- 172 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 1,100
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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