![N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea structure](/static/products/3387/338752-75-3.webp)
N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea
TL;DR: N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea (CAS 338752-75-3) is a chemical compound with molecular formula C13H17F3N2O2S2 and molecular weight 354.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[bis(ethylsulfanyl)methyl]-3-[4-(trifluoromethoxy)phenyl]urea
Also Known As: 5D-086, N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea, 1-[bis(ethylsulfanyl)methyl]-3-[4-(trifluoromethoxy)phenyl]urea, 3-[bis(ethylsulfanyl)methyl]-1-[4-(trifluoromethoxy)phenyl]urea
| Molecular Formula | C13H17F3N2O2S2 |
|---|---|
| Molecular Weight | 354.07 g/mol |
| LogP | 4.4965 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 354.06836 |
| Heavy Atoms | 22 |
| Complexity | 463.34818 |
Chemical Identifiers
| CAS Number | 338752-75-3 |
|---|---|
| SMILES | CCSC(NC(=O)NC1=CC=C(C=C1)OC(F)(F)F)SCC |
Product Overview
N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea (CAS 338752-75-3), with molecular formula C13H17F3N2O2S2 and molecular weight 354.07 g/mol. IUPAC: 1-[bis(ethylsulfanyl)methyl]-3-[4-(trifluoromethoxy)phenyl]urea.
Chemical Property Profile of N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea
Property Insights of N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea
The XLogP value of 4.4965 indicates that N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea has 2 hydrogen bond donor(s) and 4 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 N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea?
The CAS number of N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea is 338752-75-3.
What is the molecular formula of N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea?
The molecular formula of N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea is C13H17F3N2O2S2.
What is the molecular weight of N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea?
The molecular weight of N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea is 354.07 g/mol.
Where can I buy N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea?
You can request a quote for N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea?
Yes, KEHONG BIO provides custom synthesis services for N-[bis(ethylsulfanyl)methyl]-N'-[4-(trifluoromethoxy)phenyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.