1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide
TL;DR: 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide (CAS 1022454-89-2) is a chemical compound with molecular formula C16H13ClF3N3O4 and molecular weight 403.05466 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-chlorophenyl)-3-[[2-[4-(trifluoromethoxy)phenoxy]acetyl]amino]urea
Also Known As: 1-(2-(4-TRIFLUOROMETHOXYPHENOXY)ACETYL)-4-(2-CHLOROPHENYL)SEMICARBAZIDE, 1-(2-chlorophenyl)-3-[[2-[4-(trifluoromethoxy)phenoxy]acetyl]amino]urea, N-{[(2-chlorophenyl)carbamoyl]amino}-2-[4-(trifluoromethoxy)phenoxy]acetamide, C16H13ClF3N3O4
Technical Specifications
| Molecular Formula | C16H13ClF3N3O4 |
| Molecular Weight | 403.05466 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 88.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.05466 Da |
| Heavy Atoms | 27 |
| Complexity | 502.0 |
| SMILES | C1=CC=C(C(=C1)NC(=O)NNC(=O)COC2=CC=C(C=C2)OC(F)(F)F)Cl |
| InChIKey | HVYHWINAQOAXDN-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide
Property Insights of 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide
The XLogP value of 3.9 indicates that 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide. Following Lipinski's Rule of Five, 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide?
The CAS number of 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide is 1022454-89-2.
What is the molecular formula of 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide?
The molecular formula of 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide is C16H13ClF3N3O4.
What is the molecular weight of 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide?
The molecular weight of 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide is 403.05466 g/mol.
Where can I buy 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide?
You can request a quote for 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide?
Yes, CoreyChem provides custom synthesis services for 1-(2-(4-Trifluoromethoxyphenoxy)acetyl)-4-(2-chlorophenyl)semicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.