(E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide
TL;DR: (E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide (CAS 370853-42-2) is a chemical compound with molecular formula C29H29N3O4 and molecular weight 483.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-tert-butyl-N-[2-hydroxy-1-(2-phenylethyl)indol-3-yl]imino-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: (E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide, [7-(tert-butyl)(2H,3H-benzo[e]1,4-dioxin-2-yl)]-N-{[2-oxo-1-(2-phenylethyl)ben zo[d]azolin-3-ylidene]azamethyl}carboxamide, 6-tert-butyl-N-[(2-oxo-1-phenethylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide, 7-tert-butyl-N'-[(3E)-2-oxo-1-(2-phenylethyl)-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide
| Molecular Formula | C29H29N3O4 |
|---|---|
| Molecular Weight | 483.22 g/mol |
| LogP | 6.3374 |
| Topological Polar Surface Area | 85.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 483.21582 |
| Heavy Atoms | 36 |
| Complexity | 1434.4292 |
Chemical Identifiers
| CAS Number | 370853-42-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC2=C(C=C1)OCC(O2)C(=O)N=NC3=C(N(C4=CC=CC=C43)CCC5=CC=CC=C5)O |
Product Overview
(E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide (CAS 370853-42-2), with molecular formula C29H29N3O4 and molecular weight 483.22 g/mol. IUPAC: 6-tert-butyl-N-[2-hydroxy-1-(2-phenylethyl)indol-3-yl]imino-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of (E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide
Property Insights of (E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide
The XLogP value of 6.3374 indicates that (E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-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)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide. Following Lipinski's Rule of Five, (E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-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)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
The CAS number of (E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is 370853-42-2.
What is the molecular formula of (E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
The molecular formula of (E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is C29H29N3O4.
What is the molecular weight of (E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
The molecular weight of (E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is 483.22 g/mol.
Where can I buy (E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
You can request a quote for (E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-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)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-7-(tert-butyl)-N'-(2-oxo-1-phenethylindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.