![(E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide structure](/static/products/384/384356-28-9.png)
(E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide
TL;DR: (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide (CAS 384356-28-9) is a chemical compound with molecular formula C24H22BrN3O4 and molecular weight 495.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-bromo-2-hydroxy-1-prop-2-ynylindol-3-yl)imino-6-tert-butyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide, N'-[(3E)-5-bromo-2-oxo-1-(prop-2-yn-1-yl)-1,2-dihydro-3H-indol-3-ylidene]-7-tert-butyl-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide, N-[(5-bromo-2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-6-tert-butyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide
| Molecular Formula | C24H22BrN3O4 |
|---|---|
| Molecular Weight | 495.08 g/mol |
| LogP | 5.4904 |
| Topological Polar Surface Area | 85.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 495.07938 |
| Heavy Atoms | 32 |
| Complexity | 1281.107 |
Chemical Identifiers
| CAS Number | 384356-28-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC2=C(C=C1)OCC(O2)C(=O)N=NC3=C(N(C4=C3C=C(C=C4)Br)CC#C)O |
Product Overview
(E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide (CAS 384356-28-9), with molecular formula C24H22BrN3O4 and molecular weight 495.08 g/mol. IUPAC: N-(5-bromo-2-hydroxy-1-prop-2-ynylindol-3-yl)imino-6-tert-butyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide
Property Insights of (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide
The XLogP value of 5.4904 indicates that (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.41 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide. Following Lipinski's Rule of Five, (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
The CAS number of (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is 384356-28-9.
What is the molecular formula of (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
The molecular formula of (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is C24H22BrN3O4.
What is the molecular weight of (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
The molecular weight of (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is 495.08 g/mol.
Where can I buy (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
You can request a quote for (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-(5-bromo-2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.