2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate
TL;DR: 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate (CAS 1008093-11-5) is a chemical compound with molecular formula C21H21NO6 and molecular weight 383.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl] 2-acetamido-3-phenylpropanoate
Also Known As: 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate, 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl N-acetylphenylalaninate, [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl] 2-acetamido-3-phenylpropanoate, 2-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-2-OXOETHYL 2-ACETAMIDO-3-PHENYLPROPANOATE
| Molecular Formula | C21H21NO6 |
|---|---|
| Molecular Weight | 383.14 g/mol |
| LogP | 1.9311 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 383.1369 |
| Heavy Atoms | 28 |
| Complexity | 864.45447 |
Chemical Identifiers
| CAS Number | 1008093-11-5 |
|---|---|
| SMILES | CC(=O)NC(CC1=CC=CC=C1)C(=O)OCC(=O)C2=CC3=C(C=C2)OCCO3 |
Product Overview
2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate (CAS 1008093-11-5), with molecular formula C21H21NO6 and molecular weight 383.14 g/mol. IUPAC: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl] 2-acetamido-3-phenylpropanoate.
Chemical Property Profile of 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate
Property Insights of 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate
The XLogP value of 1.9311 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate. The TPSA of 90.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate. Following Lipinski's Rule of Five, 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate has 1 hydrogen bond donor(s) and 6 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-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate?
The CAS number of 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate is 1008093-11-5.
What is the molecular formula of 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate?
The molecular formula of 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate is C21H21NO6.
What is the molecular weight of 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate?
The molecular weight of 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate is 383.14 g/mol.
Where can I buy 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate?
You can request a quote for 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 2-acetamido-3-phenylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.