![[2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate structure](/static/products/124/1240748-60-0.png)
[2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate
TL;DR: [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate (CAS 1240748-60-0) is a chemical compound with molecular formula C20H15ClN2O6 and molecular weight 414.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate
Also Known As: [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate|2-(Benzo[d][1,3]dioxol-5-yl)-2-oxoethyl 3-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate
| Molecular Formula | C20H15ClN2O6 |
|---|---|
| Molecular Weight | 414.06 g/mol |
| LogP | 3.4774 |
| Topological Polar Surface Area | 100.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 414.06186 |
| Heavy Atoms | 29 |
| Complexity | 1047.3799 |
Chemical Identifiers
| CAS Number | 1240748-60-0 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C(=O)COC(=O)CCC3=NC(=NO3)C4=CC=C(C=C4)Cl |
Product Overview
[2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate (CAS 1240748-60-0), with molecular formula C20H15ClN2O6 and molecular weight 414.06 g/mol. IUPAC: [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate.
Chemical Property Profile of [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate
Property Insights of [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate
The XLogP value of 3.4774 indicates that [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.75 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate. Following Lipinski's Rule of Five, [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate has 0 hydrogen bond donor(s) and 8 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-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate?
The CAS number of [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate is 1240748-60-0.
What is the molecular formula of [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate?
The molecular formula of [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate is C20H15ClN2O6.
What is the molecular weight of [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate?
The molecular weight of [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate is 414.06 g/mol.
Where can I buy [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate?
You can request a quote for [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.