Win 1161-3
TL;DR: Win 1161-3 (CAS 60662-79-5) is a chemical compound with molecular formula C20H28ClNO2S and molecular weight 381.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethylsulfonyl-N,N-dimethyl-4,4-diphenylbutan-2-amine;hydrochloride
Also Known As: Methiodone, METHIODONE HCL, IC-26 HYDROCHLORIDE, IC-26 HCL, I-C 26
| Molecular Formula | C20H28ClNO2S |
|---|---|
| Molecular Weight | 381.15 g/mol |
| LogP | 4.13 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 381.15292 |
| Heavy Atoms | 25 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 60662-79-5 |
|---|---|
| SMILES | CCS(=O)(=O)C(CC(C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2.Cl |
| InChIKey | AFUZENUOVAPATD-UHFFFAOYSA-N |
Product Overview
Win 1161-3 (CAS 60662-79-5), with molecular formula C20H28ClNO2S and molecular weight 381.15 g/mol. IUPAC: 4-ethylsulfonyl-N,N-dimethyl-4,4-diphenylbutan-2-amine;hydrochloride.
Chemical Property Profile of Win 1161-3
Property Insights of Win 1161-3
The XLogP value of 4.13 indicates that Win 1161-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, Win 1161-3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Win 1161-3 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Win 1161-3?
The CAS number of Win 1161-3 is 60662-79-5.
What is the molecular formula of Win 1161-3?
The molecular formula of Win 1161-3 is C20H28ClNO2S.
What is the molecular weight of Win 1161-3?
The molecular weight of Win 1161-3 is 381.15 g/mol.
Where can I buy Win 1161-3?
You can request a quote for Win 1161-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Win 1161-3?
Yes, KEHONG BIO provides custom synthesis services for Win 1161-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.