![1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea) structure](/static/products/5754/5754-13-2.webp)
1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea)
TL;DR: 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea) (CAS 5754-13-2) is a chemical compound with molecular formula C26H38N4O2S2 and molecular weight 502.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(2-methylphenyl)sulfanylethyl]-3-[6-[2-(2-methylphenyl)sulfanylethylcarbamoylamino]hexyl]urea
Also Known As: 1,1'-hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea), N,N'-Hexane-1,6-diylbis(N'-{2-[(2-methylphenyl)sulfanyl]ethyl}urea), {[2-(2-methylphenylthio)ethyl]amino}-N-[6-({N-[2-(2-methylphenylthio)ethyl]car bamoyl}amino)hexyl]carboxamide, 1-[2-(2-methylphenyl)sulfanylethyl]-3-[6-[2-(2-methylphenyl)sulfanylethylcarbamoylamino]hexyl]urea, 3-[2-(2-methylphenyl)sulfanylethyl]-1-[6-[2-(2-methylphenyl)sulfanylethylcarbamoylamino]hexyl]urea
| Molecular Formula | C26H38N4O2S2 |
|---|---|
| Molecular Weight | 502.24 g/mol |
| LogP | 5.34664 |
| Topological Polar Surface Area | 82.26 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 502.24362 |
| Heavy Atoms | 34 |
| Complexity | 807.88403 |
Chemical Identifiers
| CAS Number | 5754-13-2 |
|---|---|
| SMILES | CC1=CC=CC=C1SCCNC(=O)NCCCCCCNC(=O)NCCSC2=CC=CC=C2C |
Product Overview
1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea) (CAS 5754-13-2), with molecular formula C26H38N4O2S2 and molecular weight 502.24 g/mol. IUPAC: 1-[2-(2-methylphenyl)sulfanylethyl]-3-[6-[2-(2-methylphenyl)sulfanylethylcarbamoylamino]hexyl]urea.
Chemical Property Profile of 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea)
Property Insights of 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea)
The XLogP value of 5.34664 indicates that 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea). Following Lipinski's Rule of Five, 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea) has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea)?
The CAS number of 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea) is 5754-13-2.
What is the molecular formula of 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea)?
The molecular formula of 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea) is C26H38N4O2S2.
What is the molecular weight of 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea)?
The molecular weight of 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea) is 502.24 g/mol.
Where can I buy 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea)?
You can request a quote for 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea)?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Hexane-1,6-diylbis(3-{2-[(2-methylphenyl)sulfanyl]ethyl}urea) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.