![1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate structure](/static/products/4552/455290-01-4.webp)
1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate
TL;DR: 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate (CAS 455290-01-4) is a chemical compound with molecular formula C14H12Cl3NO5 and molecular weight 378.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-oxo-1-(2,4,5-trichloroanilino)propan-2-yl] 2,3-dihydro-1,4-dioxine-5-carboxylate
Also Known As: 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate, [1-oxo-1-(2,4,5-trichloroanilino)propan-2-yl] 2,3-dihydro-1,4-dioxine-5-carboxylate, 1-Oxo-1-(2,4,5-trichloroanilino)propan-2-yl 5,6-dihydro-1,4-dioxine-2-carboxylate
| Molecular Formula | C14H12Cl3NO5 |
|---|---|
| Molecular Weight | 378.98 g/mol |
| LogP | 3.4052 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 378.97812 |
| Heavy Atoms | 23 |
| Complexity | 662.058 |
Chemical Identifiers
| CAS Number | 455290-01-4 |
|---|---|
| SMILES | CC(C(=O)NC1=CC(=C(C=C1Cl)Cl)Cl)OC(=O)C2=COCCO2 |
Product Overview
1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate (CAS 455290-01-4), with molecular formula C14H12Cl3NO5 and molecular weight 378.98 g/mol. IUPAC: [1-oxo-1-(2,4,5-trichloroanilino)propan-2-yl] 2,3-dihydro-1,4-dioxine-5-carboxylate.
Chemical Property Profile of 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate
Property Insights of 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate
The XLogP value of 3.4052 indicates that 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate. Following Lipinski's Rule of Five, 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate has 1 hydrogen bond donor(s) and 5 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-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate?
The CAS number of 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate is 455290-01-4.
What is the molecular formula of 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate?
The molecular formula of 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate is C14H12Cl3NO5.
What is the molecular weight of 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate?
The molecular weight of 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate is 378.98 g/mol.
Where can I buy 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate?
You can request a quote for 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-2-oxo-2-[(2,4,5-trichlorophenyl)amino]ethyl 5,6-dihydro-1,4-dioxin-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.