Bis(2-(2-octenoylamino)ethyl)disulfide
TL;DR: Bis(2-(2-octenoylamino)ethyl)disulfide (CAS 112614-16-1) is a chemical compound with molecular formula C20H36N2O2S2 and molecular weight 400.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[2-[2-[[(E)-oct-2-enoyl]amino]ethyldisulfanyl]ethyl]oct-2-enamide
Also Known As: B-2-Oaed, Compound I-3, 2-Undecenoyl chloride, Bis(2-(2-octenoylamino)ethyl)disulfide, (E)-N-[2-[2-[[(E)-oct-2-enoyl]amino]ethyldisulfanyl]ethyl]oct-2-enamide
| Molecular Formula | C20H36N2O2S2 |
|---|---|
| Molecular Weight | 400.22 g/mol |
| LogP | 4.8732 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 17 |
| Exact Mass | 400.22183 |
| Heavy Atoms | 26 |
| Complexity | 374.61536 |
Chemical Identifiers
| CAS Number | 112614-16-1 |
|---|---|
| SMILES | CCCCC/C=C/C(=O)NCCSSCCNC(=O)/C=C/CCCCC |
Product Overview
Bis(2-(2-octenoylamino)ethyl)disulfide (CAS 112614-16-1), with molecular formula C20H36N2O2S2 and molecular weight 400.22 g/mol. IUPAC: (E)-N-[2-[2-[[(E)-oct-2-enoyl]amino]ethyldisulfanyl]ethyl]oct-2-enamide.
Chemical Property Profile of Bis(2-(2-octenoylamino)ethyl)disulfide
Property Insights of Bis(2-(2-octenoylamino)ethyl)disulfide
The XLogP value of 4.8732 indicates that Bis(2-(2-octenoylamino)ethyl)disulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, Bis(2-(2-octenoylamino)ethyl)disulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(2-(2-octenoylamino)ethyl)disulfide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis(2-(2-octenoylamino)ethyl)disulfide?
The CAS number of Bis(2-(2-octenoylamino)ethyl)disulfide is 112614-16-1.
What is the molecular formula of Bis(2-(2-octenoylamino)ethyl)disulfide?
The molecular formula of Bis(2-(2-octenoylamino)ethyl)disulfide is C20H36N2O2S2.
What is the molecular weight of Bis(2-(2-octenoylamino)ethyl)disulfide?
The molecular weight of Bis(2-(2-octenoylamino)ethyl)disulfide is 400.22 g/mol.
Where can I buy Bis(2-(2-octenoylamino)ethyl)disulfide?
You can request a quote for Bis(2-(2-octenoylamino)ethyl)disulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2-(2-octenoylamino)ethyl)disulfide?
Yes, KEHONG BIO provides custom synthesis services for Bis(2-(2-octenoylamino)ethyl)disulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.