N,N'-(Dithiobis(4,1-phenylene))didodecanamide
TL;DR: N,N'-(Dithiobis(4,1-phenylene))didodecanamide (CAS 5758-13-4) is a chemical compound with molecular formula C36H56N2O2S2 and molecular weight 612.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[[4-(dodecanoylamino)phenyl]disulfanyl]phenyl]dodecanamide
Also Known As: Aminobenzene disulfide analog, N,N'-(Dithiobis(4,1-phenylene))didodecanamide, 4',4'''-DITHIODIDODECANANILIDE, dodecanamide, n,n'-(dithiodi-4,1-phenylene)bis-, DODECANANILIDE, 4',4'''-DITHIOBIS-
| Molecular Formula | C36H56N2O2S2 |
|---|---|
| Molecular Weight | 612.38 g/mol |
| LogP | 12.7 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 25 |
| Exact Mass | 612.3783 |
| Heavy Atoms | 42 |
| Complexity | 605.0 |
Chemical Identifiers
| CAS Number | 5758-13-4 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)NC1=CC=C(C=C1)SSC2=CC=C(C=C2)NC(=O)CCCCCCCCCCC |
| InChIKey | IDJUDSPIWBZZKZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N'-(Dithiobis(4,1-phenylene))didodecanamide (CAS 5758-13-4), with molecular formula C36H56N2O2S2 and molecular weight 612.38 g/mol. IUPAC: N-[4-[[4-(dodecanoylamino)phenyl]disulfanyl]phenyl]dodecanamide.
Chemical Property Profile of N,N'-(Dithiobis(4,1-phenylene))didodecanamide
Property Insights of N,N'-(Dithiobis(4,1-phenylene))didodecanamide
The XLogP value of 12.7 indicates that N,N'-(Dithiobis(4,1-phenylene))didodecanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N'-(Dithiobis(4,1-phenylene))didodecanamide. Following Lipinski's Rule of Five, N,N'-(Dithiobis(4,1-phenylene))didodecanamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N'-(Dithiobis(4,1-phenylene))didodecanamide?
The CAS number of N,N'-(Dithiobis(4,1-phenylene))didodecanamide is 5758-13-4.
What is the molecular formula of N,N'-(Dithiobis(4,1-phenylene))didodecanamide?
The molecular formula of N,N'-(Dithiobis(4,1-phenylene))didodecanamide is C36H56N2O2S2.
What is the molecular weight of N,N'-(Dithiobis(4,1-phenylene))didodecanamide?
The molecular weight of N,N'-(Dithiobis(4,1-phenylene))didodecanamide is 612.38 g/mol.
Where can I buy N,N'-(Dithiobis(4,1-phenylene))didodecanamide?
You can request a quote for N,N'-(Dithiobis(4,1-phenylene))didodecanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-(Dithiobis(4,1-phenylene))didodecanamide?
Yes, KEHONG BIO provides custom synthesis services for N,N'-(Dithiobis(4,1-phenylene))didodecanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.