(E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate
TL;DR: (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate (CAS 370845-46-8) is a chemical compound with molecular formula C25H27N3O6 and molecular weight 465.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-[(6-tert-butyl-2,3-dihydro-1,4-benzodioxine-3-carbonyl)diazenyl]-2-hydroxyindol-1-yl]acetate
Also Known As: (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate, ethyl [(3E)-3-{2-[(7-tert-butyl-2,3-dihydro-1,4-benzodioxin-2-yl)carbonyl]hydrazinylidene}-2-oxo-2,3-dihydro-1H-indol-1-yl]acetate, ethyl 2-[(3E)-3-[(6-tert-butyl-2,3-dihydro-1,4-benzodioxine-3-carbonyl)hydrazinylidene]-2-oxoindol-1-yl]acetate, ethyl 2-[3-[(6-tert-butyl-2,3-dihydro-1,4-benzodioxine-3-carbonyl)hydrazinylidene]-2-oxoindol-1-yl]acetate
| Molecular Formula | C25H27N3O6 |
|---|---|
| Molecular Weight | 465.19 g/mol |
| LogP | 4.6578 |
| Topological Polar Surface Area | 111.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 465.18997 |
| Heavy Atoms | 34 |
| Complexity | 1271.627 |
Chemical Identifiers
| CAS Number | 370845-46-8 |
|---|---|
| SMILES | CCOC(=O)CN1C2=CC=CC=C2C(=C1O)N=NC(=O)C3COC4=C(O3)C=C(C=C4)C(C)(C)C |
Product Overview
(E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate (CAS 370845-46-8), with molecular formula C25H27N3O6 and molecular weight 465.19 g/mol. IUPAC: ethyl 2-[3-[(6-tert-butyl-2,3-dihydro-1,4-benzodioxine-3-carbonyl)diazenyl]-2-hydroxyindol-1-yl]acetate.
Chemical Property Profile of (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate
Property Insights of (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate
The XLogP value of 4.6578 indicates that (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.71 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate. Following Lipinski's Rule of Five, (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate has 1 hydrogen bond donor(s) and 7 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 (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate?
The CAS number of (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate is 370845-46-8.
What is the molecular formula of (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate?
The molecular formula of (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate is C25H27N3O6.
What is the molecular weight of (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate?
The molecular weight of (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate is 465.19 g/mol.
Where can I buy (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate?
You can request a quote for (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 2-(3-(2-(7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbonyl)hydrazono)-2-oxoindolin-1-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.