RefChem:77066
TL;DR: RefChem:77066 (CAS 67905-14-0) is a chemical compound with molecular formula C36H60N4O10S2 and molecular weight 772.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[9,10-dioxo-4-[3-(triethylazaniumyl)propylamino]anthracen-1-yl]amino]propyl-triethylazanium;ethyl sulfate
Also Known As: 2,6-dimethylheptan-4-amine, diethyl3,3'-[diimino]bis[triethylpropylammonium]disulphate, 1-Propanaminium, 3,3'-[(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)diimino]bis[N,N,N-triethyl-, bis(ethyl sulfate), (1,4-Anthraquinonylenebis(iminotrimethylene))bis(triethylammonium), bis(ethyl sulfate), 1-Propanaminium, 3,3'-((9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)diimino)bis(N,N,N-triethyl-, ethyl sulfate (1:2)
| Molecular Formula | C36H60N4O10S2 |
|---|---|
| Molecular Weight | 772.38 g/mol |
| LogP | 4.79 |
| Topological Polar Surface Area | 208.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 18 |
| Exact Mass | 772.37506 |
| Heavy Atoms | 52 |
| Complexity | 773.0 |
Chemical Identifiers
| CAS Number | 67905-14-0 |
|---|---|
| SMILES | CC[N+](CC)(CC)CCCNC1=C2C(=C(C=C1)NCCC[N+](CC)(CC)CC)C(=O)C3=CC=CC=C3C2=O.CCOS(=O)(=O)[O-].CCOS(=O)(=O)[O-] |
| InChIKey | WKEDGSBYZJXGQP-UHFFFAOYSA-N |
Product Overview
RefChem:77066 (CAS 67905-14-0), with molecular formula C36H60N4O10S2 and molecular weight 772.38 g/mol. IUPAC: 3-[[9,10-dioxo-4-[3-(triethylazaniumyl)propylamino]anthracen-1-yl]amino]propyl-triethylazanium;ethyl sulfate.
Chemical Property Profile of RefChem:77066
Property Insights of RefChem:77066
The XLogP value of 4.79 indicates that RefChem:77066 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 208.0 Ų indicates high polarity, suggesting RefChem:77066 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:77066 has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:77066?
The CAS number of RefChem:77066 is 67905-14-0.
What is the molecular formula of RefChem:77066?
The molecular formula of RefChem:77066 is C36H60N4O10S2.
What is the molecular weight of RefChem:77066?
The molecular weight of RefChem:77066 is 772.38 g/mol.
Where can I buy RefChem:77066?
You can request a quote for RefChem:77066 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:77066?
Yes, KEHONG BIO provides custom synthesis services for RefChem:77066 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.