5-Dembs
TL;DR: 5-Dembs (CAS 125153-59-5) is a chemical compound with molecular formula C25H35N3O5S and molecular weight 489.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[3-cyano-6-[2-(2-ethoxyphenoxy)ethylamino]-2-methylhexan-3-yl]-2-methoxybenzenesulfonamide
Also Known As: 5-Dembs, 5-(1-Cyano-4-((2-(2-ethoxyphenoxy)ethyl)amino)-1-isopropylbutyl)-2-methoxybenzenesulfonamide, 5-[3-cyano-6-[2-(2-ethoxyphenoxy)ethylamino]-2-methylhexan-3-yl]-2-methoxybenzenesulfonamide, Benzenesulfonamide,5-[1-cyano-4-[[2-(2-ethoxyphenoxy)ethyl]amino]-1-(1-methylethyl)butyl]-2-methoxy-, 5-(3-Cyano-6-{[2-(2-ethoxyphenoxy)ethyl]amino}-2-methylhexan-3-yl)-2-methoxybenzene-1-sulfonamide
| Molecular Formula | C25H35N3O5S |
|---|---|
| Molecular Weight | 489.23 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 14 |
| Exact Mass | 489.22974 |
| Heavy Atoms | 34 |
| Complexity | 747.0 |
Chemical Identifiers
| CAS Number | 125153-59-5 |
|---|---|
| SMILES | CCOC1=CC=CC=C1OCCNCCCC(C#N)(C2=CC(=C(C=C2)OC)S(=O)(=O)N)C(C)C |
| InChIKey | OALWONWDRJKTCS-UHFFFAOYSA-N |
Product Overview
5-Dembs (CAS 125153-59-5), with molecular formula C25H35N3O5S and molecular weight 489.23 g/mol. IUPAC: 5-[3-cyano-6-[2-(2-ethoxyphenoxy)ethylamino]-2-methylhexan-3-yl]-2-methoxybenzenesulfonamide.
Chemical Property Profile of 5-Dembs
Property Insights of 5-Dembs
The XLogP value of 3.6 indicates that 5-Dembs is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Dembs. Following Lipinski's Rule of Five, 5-Dembs has 2 hydrogen bond donor(s) and 8 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 5-Dembs?
The CAS number of 5-Dembs is 125153-59-5.
What is the molecular formula of 5-Dembs?
The molecular formula of 5-Dembs is C25H35N3O5S.
What is the molecular weight of 5-Dembs?
The molecular weight of 5-Dembs is 489.23 g/mol.
Where can I buy 5-Dembs?
You can request a quote for 5-Dembs directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Dembs?
Yes, KEHONG BIO provides custom synthesis services for 5-Dembs and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.