Win 4981
TL;DR: Win 4981 (CAS 3572-35-8) is a chemical compound with molecular formula C20H40I2N4O2 and molecular weight 622.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[6-[3-[diethyl(methyl)azaniumyl]propoxy]pyridazin-3-yl]oxypropyl-diethyl-methylazanium diiodide
Also Known As: WIN 4981, 3,6-Bis(3-diethylaminopropoxy)pyridazine bis-methiodide, (3,6-Pyridazinediylbis(oxytrimethylene))bis(diethylmethylammonium iodide), AMMONIUM, (3,6-PYRIDAZINEDIYLBIS(OXYTRIMETHYLENE))BIS(DIETHYLMETHYL-, DIIODIDE, 1-Propanaminium, 3,3'-(3,6-pyridazinediylbis(oxy))bis(N,N-diethyl-N-methyl-, diiodide
| Molecular Formula | C20H40I2N4O2 |
|---|---|
| Molecular Weight | 622.12 g/mol |
| LogP | -3.0 |
| Topological Polar Surface Area | 44.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 622.1241 |
| Heavy Atoms | 28 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 3572-35-8 |
|---|---|
| SMILES | CC[N+](C)(CC)CCCOC1=NN=C(C=C1)OCCC[N+](C)(CC)CC.[I-].[I-] |
| InChIKey | WQIWPUPXTLTIRV-UHFFFAOYSA-L |
Product Overview
Win 4981 (CAS 3572-35-8), with molecular formula C20H40I2N4O2 and molecular weight 622.12 g/mol. IUPAC: 3-[6-[3-[diethyl(methyl)azaniumyl]propoxy]pyridazin-3-yl]oxypropyl-diethyl-methylazanium diiodide.
Chemical Property Profile of Win 4981
Property Insights of Win 4981
The XLogP value of -3.0 indicates that Win 4981 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 44.2 Ų, Win 4981 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Win 4981 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Win 4981?
The CAS number of Win 4981 is 3572-35-8.
What is the molecular formula of Win 4981?
The molecular formula of Win 4981 is C20H40I2N4O2.
What is the molecular weight of Win 4981?
The molecular weight of Win 4981 is 622.12 g/mol.
Where can I buy Win 4981?
You can request a quote for Win 4981 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Win 4981?
Yes, KEHONG BIO provides custom synthesis services for Win 4981 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.