Basic information
- CAS
5325-83-7- Standard SMILES
CCCCCCCCCCCC(=O)Nc1ccc(SSc2ccc(NC(=O)CCCCCCCCCCC)cc2)cc1- InChIKey
IDJUDSPIWBZZKZ-UHFFFAOYSA-N- Molecular formula
- C36H56N2O2S2
- Average molar mass
- 613 g/mol
- Monoisotopic mass
- 612.37832138
Names & identifiers
- Preferred name
- N,N'-(Dithiobis(4,1-phenylene))didodecanamide
- IUPAC
- N-[4-[[4-(dodecanoylamino)phenyl]disulfanyl]phenyl]dodecanamide
Names & synonyms
N,N'-(Dithiobis(4,1-phenylene))didodecanamide5325-83-7NSC 2203Z5M498DE5UNII-3Z5M498DE5NSC-220dodecanamide, n,n'-(dithiodi-4,1-phenylene)bis-DTXSID60201359DODECANANILIDE, 4',4'''-DITHIOBIS-N,N'-[Dithiobis(4,1-phenylene)]didodecanamideRefChem:160908DTXCID10123850
Show more names
NSC2204',4'''-DITHIODIDODECANANILIDECHEMBL121012SCHEMBL9445667N-[4-[[4-(dodecanoylamino)phenyl]disulfanyl]phenyl]dodecanamideN,N'-[Disulfanediyldi(4,1-phenylene)]didodecanamide
Database identifiers
- CAS
5325-83-7- PubChem CID
- 219216
- DTXSID
DTXSID60201359- ChEMBL
CHEMBL121012- UNII
- 3Z5M498DE5
Properties
Computed structural properties
- XLogP
- 12.7
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 25
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 605
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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