N,N'-[Hexane-1,6-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dioctanamide
Basic information
- CAS
87202-69-5- Standard SMILES
CCCCCCCC(=O)Nc1nnc(SCCCCCCSc2nnc(NC(=O)CCCCCCC)s2)s1- InChIKey
NDHBNQUDUPRJCX-UHFFFAOYSA-N- Molecular formula
- C26H44N6O2S4
- Average molar mass
- 600.9 g/mol
- Monoisotopic mass
- 600.24085936
Names & identifiers
- Preferred name
- N,N'-[Hexane-1,6-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dioctanamide
- IUPAC
- N-[5-[6-[[5-(octanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]hexylsulfanyl]-1,3,4-thiadiazol-2-yl]octanamide
- English name
- N-[5-[6-[[5-(octanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]hexylsulfan yl]-1,3,4-thiadiazol-2-yl]octanamide
- Molecular formula
- C26H44N6O2S4
- Molecular weight
- 0
Names & synonyms
87202-69-5NSC360369DTXSID60320498NSC-360369N,N'-[Hexane-1,6-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dioctanamideN-[5-[6-[[5-(octanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]hexylsulfan yl]-1,3,4-thiadiazol-2-yl]octanamide
Database identifiers
- CAS
87202-69-5- PubChem CID
- 338364
- DTXSID
DTXSID60320498
Properties
Computed structural properties
- XLogP
- 8.6
- Topological polar surface area
- 217 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 23
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 585
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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