1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE
TL;DR: 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE (CAS 1024225-00-0) is a chemical compound with molecular formula C17H13F6N3O3S and molecular weight 453.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-[4-(trifluoromethoxy)phenoxy]acetyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea
Also Known As: 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE, 1-[[2-[4-(trifluoromethoxy)phenoxy]acetyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea, 3-[[2-[4-(trifluoromethoxy)phenoxy]acetyl]amino]-1-[3-(trifluoromethyl)phenyl]thiourea, 2-[4-(trifluoromethoxy)phenoxy]-N-({[3-(trifluoromethyl)phenyl]carbamothioyl}amino)acetamide, C17H13F6N3O3S
| Molecular Formula | C17H13F6N3O3S |
|---|---|
| Molecular Weight | 453.06 g/mol |
| LogP | 4.0006 |
| Topological Polar Surface Area | 71.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.05817 |
| Heavy Atoms | 30 |
| Complexity | 887.5427 |
Chemical Identifiers
| CAS Number | 1024225-00-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=S)NNC(=O)COC2=CC=C(C=C2)OC(F)(F)F)C(F)(F)F |
Product Overview
1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE (CAS 1024225-00-0), with molecular formula C17H13F6N3O3S and molecular weight 453.06 g/mol. IUPAC: 1-[[2-[4-(trifluoromethoxy)phenoxy]acetyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea.
Chemical Property Profile of 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE
Property Insights of 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE
The XLogP value of 4.0006 indicates that 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE. Following Lipinski's Rule of Five, 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE has 3 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 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE?
The CAS number of 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE is 1024225-00-0.
What is the molecular formula of 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE?
The molecular formula of 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE is C17H13F6N3O3S.
What is the molecular weight of 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE?
The molecular weight of 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE is 453.06 g/mol.
Where can I buy 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE?
You can request a quote for 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(3-TRIFLUOROMETHYLPHENYL)THIOSEMICARBAZIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.