![1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea structure](/static/products/371/371199-53-0.png)
1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea
TL;DR: 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea (CAS 371199-53-0) is a chemical compound with molecular formula C18H23F3N4OS2 and molecular weight 432.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea
Also Known As: 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea, 1-(5-(6-(ethylthio)hexyl)-1,3,4-thiadiazol-2-yl)-3-(3-(trifluoromethyl)phenyl)urea, 1-[(2Z)-5-[6-(ethylsulfanyl)hexyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-[3-(trifluoromethyl)phenyl]urea
| Molecular Formula | C18H23F3N4OS2 |
|---|---|
| Molecular Weight | 432.13 g/mol |
| LogP | 6.0569 |
| Topological Polar Surface Area | 66.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 432.12653 |
| Heavy Atoms | 28 |
| Complexity | 752.4271 |
Chemical Identifiers
| CAS Number | 371199-53-0 |
|---|---|
| SMILES | CCSCCCCCCC1=NN=C(S1)NC(=O)NC2=CC=CC(=C2)C(F)(F)F |
Product Overview
1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea (CAS 371199-53-0), with molecular formula C18H23F3N4OS2 and molecular weight 432.13 g/mol. IUPAC: 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea.
Chemical Property Profile of 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea
Property Insights of 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea
The XLogP value of 6.0569 indicates that 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea. Following Lipinski's Rule of Five, 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea?
The CAS number of 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea is 371199-53-0.
What is the molecular formula of 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea?
The molecular formula of 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea is C18H23F3N4OS2.
What is the molecular weight of 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea?
The molecular weight of 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea is 432.13 g/mol.
Where can I buy 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea?
You can request a quote for 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-[5-(6-ethylsulfanylhexyl)-1,3,4-thiadiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.