![N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea structure](/static/products/6469/646989-55-1.webp)
N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea
TL;DR: N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea (CAS 646989-55-1) is a chemical compound with molecular formula C6H2Cl3F3N4OS and molecular weight 339.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,2,2-trichloroethenyl)-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea
Also Known As: N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea, 1-(1,2,2-trichloroethenyl)-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea, 3-(trichloroethenyl)-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea
| Molecular Formula | C6H2Cl3F3N4OS |
|---|---|
| Molecular Weight | 339.90 g/mol |
| LogP | 3.5214 |
| Topological Polar Surface Area | 66.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 339.8967 |
| Heavy Atoms | 18 |
| Complexity | 484.6671 |
Chemical Identifiers
| CAS Number | 646989-55-1 |
|---|---|
| SMILES | C1(=NN=C(S1)NC(=O)NC(=C(Cl)Cl)Cl)C(F)(F)F |
Product Overview
N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea (CAS 646989-55-1), with molecular formula C6H2Cl3F3N4OS and molecular weight 339.90 g/mol. IUPAC: 1-(1,2,2-trichloroethenyl)-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea.
Chemical Property Profile of N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea
Property Insights of N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea
The XLogP value of 3.5214 indicates that N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]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 N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea. Following Lipinski's Rule of Five, N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]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-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea?
The CAS number of N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea is 646989-55-1.
What is the molecular formula of N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea?
The molecular formula of N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea is C6H2Cl3F3N4OS.
What is the molecular weight of N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea?
The molecular weight of N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea is 339.90 g/mol.
Where can I buy N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea?
You can request a quote for N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea?
Yes, KEHONG BIO provides custom synthesis services for N-(1,2,2-Trichlorovinyl)-N'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.