RefChem:376481
TL;DR: RefChem:376481 (CAS 53801-77-7) is a chemical compound with molecular formula C34H58Br2Cl2N4O2S2 and molecular weight 846.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-[(5-bromo-2-pyridinyl)oxy]-N-[2-[2-[10-[(5-bromo-2-pyridinyl)oxy]decylamino]ethyldisulfanyl]ethyl]decan-1-amine;dihydrochloride
Also Known As: 2,2'-(Dithiobis(ethyleneiminodecamethyleneoxy))bis(5-bromopyridine) dihydrochloride, Disulfide, bis((2-(10-(5-bromo-2-pyridyloxy)decyl)amino)ethyl) dihydrochloride, Pyridine, 2,2'-dithiobis(ethyleneiminodecamethyleneoxy)bis(5-bromo-, dihydrochloride, n,n'-(disulfanediyldiethane-2,1-diyl)bis{10-[(5-bromopyridin-2-yl)oxy]decan-1-amine} dihydrochloride, 10-(5-bromopyridin-2-yl)oxy-N-[2-[2-[10-(5-bromopyridin-2-yl)oxydecylamino]ethyldisulfanyl]ethyl]decan-1-amine dihydrochloride
| Molecular Formula | C34H58Br2Cl2N4O2S2 |
|---|---|
| Molecular Weight | 846.17 g/mol |
| LogP | 11.1052 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 31 |
| Exact Mass | 846.1745 |
| Heavy Atoms | 46 |
| Complexity | 568.0 |
Chemical Identifiers
| CAS Number | 53801-77-7 |
|---|---|
| SMILES | C1=CC(=NC=C1Br)OCCCCCCCCCCNCCSSCCNCCCCCCCCCCOC2=NC=C(C=C2)Br.Cl.Cl |
| InChIKey | RYROWNOHCUSOKT-UHFFFAOYSA-N |
Product Overview
RefChem:376481 (CAS 53801-77-7), with molecular formula C34H58Br2Cl2N4O2S2 and molecular weight 846.17 g/mol. IUPAC: 10-[(5-bromo-2-pyridinyl)oxy]-N-[2-[2-[10-[(5-bromo-2-pyridinyl)oxy]decylamino]ethyldisulfanyl]ethyl]decan-1-amine;dihydrochloride.
Chemical Property Profile of RefChem:376481
Property Insights of RefChem:376481
The XLogP value of 11.1052 indicates that RefChem:376481 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:376481. Following Lipinski's Rule of Five, RefChem:376481 has 4 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 RefChem:376481?
The CAS number of RefChem:376481 is 53801-77-7.
What is the molecular formula of RefChem:376481?
The molecular formula of RefChem:376481 is C34H58Br2Cl2N4O2S2.
What is the molecular weight of RefChem:376481?
The molecular weight of RefChem:376481 is 846.17 g/mol.
Where can I buy RefChem:376481?
You can request a quote for RefChem:376481 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:376481?
Yes, KEHONG BIO provides custom synthesis services for RefChem:376481 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.