Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane
TL;DR: Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane (CAS 68535-69-3) is a chemical compound with molecular formula C32H58Cl4N4O2S2 and molecular weight 734.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[(2-methoxyphenyl)methyl]-N-[2-[2-[6-[(2-methoxyphenyl)methylamino]hexylamino]ethyldisulfanyl]ethyl]hexane-1,6-diamine;tetrahydrochloride
Also Known As: benextramine tetrahydrochloride, Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane, C(NCCCCCCNCCSSCCNCCCCCCNCc1ccccc1OC)c2ccccc2OC, N'-[(2-methoxyphenyl)methyl]-N-[2-[2-[6-[(2-methoxyphenyl)methylamino]hexylamino]ethyldisulfanyl]ethyl]hexane-1,6-diamine tetrahydrochloride, EINECS 271-296-9
| Molecular Formula | C32H58Cl4N4O2S2 |
|---|---|
| Molecular Weight | 734.28 g/mol |
| LogP | 7.9518 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 27 |
| Exact Mass | 734.2755 |
| Heavy Atoms | 44 |
| Complexity | 503.0 |
Chemical Identifiers
| CAS Number | 68535-69-3 |
|---|---|
| SMILES | COC1=CC=CC=C1CNCCCCCCNCCSSCCNCCCCCCNCC2=CC=CC=C2OC.Cl.Cl.Cl.Cl |
| InChIKey | RTQGTSLLFQQXBL-UHFFFAOYSA-N |
Product Overview
Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane (CAS 68535-69-3), with molecular formula C32H58Cl4N4O2S2 and molecular weight 734.28 g/mol. IUPAC: N'-[(2-methoxyphenyl)methyl]-N-[2-[2-[6-[(2-methoxyphenyl)methylamino]hexylamino]ethyldisulfanyl]ethyl]hexane-1,6-diamine;tetrahydrochloride.
Chemical Property Profile of Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane
Property Insights of Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane
The XLogP value of 7.9518 indicates that Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane. Following Lipinski's Rule of Five, Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane has 8 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane?
The CAS number of Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane is 68535-69-3.
What is the molecular formula of Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane?
The molecular formula of Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane is C32H58Cl4N4O2S2.
What is the molecular weight of Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane?
The molecular weight of Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane is 734.28 g/mol.
Where can I buy Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane?
You can request a quote for Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane?
Yes, KEHONG BIO provides custom synthesis services for Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.