![[2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate structure](/static/products/3782/378227-49-7.webp)
[2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate
TL;DR: [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate (CAS 378227-49-7) is a chemical compound with molecular formula C13H11Br2NO5 and molecular weight 418.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,4-dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate
Also Known As: [2-(2,4-dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate|(2,4-dibromophenyl)carbamoylmethyl 5,6-dihydro-1,4-dioxine-2-carboxylate|2-(2,4-Dibromoanilino)-2-oxoethyl 5,6-dihydro-1,4-dioxine-2-carboxylate|MLS002247955|SMR001315438
| Molecular Formula | C13H11Br2NO5 |
|---|---|
| Molecular Weight | 418.90 g/mol |
| LogP | 2.5815 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 418.9004 |
| Heavy Atoms | 21 |
| Complexity | 587.9244 |
Chemical Identifiers
| CAS Number | 378227-49-7 |
|---|---|
| SMILES | C1COC(=CO1)C(=O)OCC(=O)NC2=C(C=C(C=C2)Br)Br |
Product Overview
[2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate (CAS 378227-49-7), with molecular formula C13H11Br2NO5 and molecular weight 418.90 g/mol. IUPAC: [2-(2,4-dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate.
Chemical Property Profile of [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate
Property Insights of [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate
The XLogP value of 2.5815 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate. Following Lipinski's Rule of Five, [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-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 [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate?
The CAS number of [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate is 378227-49-7.
What is the molecular formula of [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate?
The molecular formula of [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate is C13H11Br2NO5.
What is the molecular weight of [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate?
The molecular weight of [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate is 418.90 g/mol.
Where can I buy [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate?
You can request a quote for [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-(2,4-Dibromoanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.