RefChem:319064
TL;DR: RefChem:319064 (CAS 73680-61-2) is a chemical compound with molecular formula C36H54Cl2N4O4 and molecular weight 676.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-[3-[diethyl-[(2-methoxyphenyl)methyl]azaniumyl]propylamino]-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]propyl-diethyl-[(2-methoxyphenyl)methyl]azanium dichloride
Also Known As: Ammonium, (p-benzoquinon-2,5-ylenebis(iminotrimethylene))bis(diethyl(o-methoxybenzyl)-, dichloride, 1,4-Benzoquinone, 2,5-bis(3-diethylaminopropylamino), bis-2-methoxybenzylchloride, 3-[[4-[3-[Diethyl-[(2-methoxyphenyl)methyl]azaniumyl]propylamino]-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]propyl-diethyl-[(2-methoxyphenyl)methyl]azaniumdichloride, 3-[[4-[3-[diethyl-[(2-methoxyphenyl)methyl]azaniumyl]propylamino]-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]propyl-diethyl-[(2-methoxyphenyl)methyl]azanium dichloride, Benzenemethanaminium, N,N'-[(3,6-dioxo-1,4-cyclohexadiene-1,4-diyl)bis(imino-3,1-propanediyl)]bis[N,N-diethyl-2-methoxy-, dichloride
| Molecular Formula | C36H54Cl2N4O4 |
|---|---|
| Molecular Weight | 676.35 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 20 |
| Exact Mass | 676.35223 |
| Heavy Atoms | 46 |
| Complexity | 880.0 |
Chemical Identifiers
| CAS Number | 73680-61-2 |
|---|---|
| SMILES | CC[N+](CC)(CCCNC1=CC(=O)C(=CC1=O)NCCC[N+](CC)(CC)CC2=CC=CC=C2OC)CC3=CC=CC=C3OC.[Cl-].[Cl-] |
| InChIKey | DSPMSCXNHOOXHU-UHFFFAOYSA-N |
Product Overview
RefChem:319064 (CAS 73680-61-2), with molecular formula C36H54Cl2N4O4 and molecular weight 676.35 g/mol. IUPAC: 3-[[4-[3-[diethyl-[(2-methoxyphenyl)methyl]azaniumyl]propylamino]-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]propyl-diethyl-[(2-methoxyphenyl)methyl]azanium dichloride.
Chemical Property Profile of RefChem:319064
Property Insights of RefChem:319064
The XLogP value of -1.0 indicates that RefChem:319064 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:319064. Following Lipinski's Rule of Five, RefChem:319064 has 2 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:319064?
The CAS number of RefChem:319064 is 73680-61-2.
What is the molecular formula of RefChem:319064?
The molecular formula of RefChem:319064 is C36H54Cl2N4O4.
What is the molecular weight of RefChem:319064?
The molecular weight of RefChem:319064 is 676.35 g/mol.
Where can I buy RefChem:319064?
You can request a quote for RefChem:319064 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:319064?
Yes, KEHONG BIO provides custom synthesis services for RefChem:319064 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.