![7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide structure](/static/products/355/355435-11-9.png)
7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide
TL;DR: 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide (CAS 355435-11-9) is a chemical compound with molecular formula C25H26N4O4 and molecular weight 446.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-tert-butyl-N-[1-(3-cyanopropyl)-2-hydroxyindol-3-yl]imino-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide, (E)-7-(tert-butyl)-N'-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide, [7-(tert-butyl)(2H,3H-benzo[e]1,4-dioxin-2-yl)]-N-{[1-(3-cyanopropyl)-2-oxoben zo[d]azolin-3-ylidene]azamethyl}carboxamide, 6-tert-butyl-N-[[1-(3-cyanopropyl)-2-oxoindol-3-ylidene]amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
| Molecular Formula | C25H26N4O4 |
|---|---|
| Molecular Weight | 446.20 g/mol |
| LogP | 5.39848 |
| Topological Polar Surface Area | 109.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 446.1954 |
| Heavy Atoms | 33 |
| Complexity | 1263.8732 |
Chemical Identifiers
| CAS Number | 355435-11-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC2=C(C=C1)OCC(O2)C(=O)N=NC3=C(N(C4=CC=CC=C43)CCCC#N)O |
Product Overview
7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide (CAS 355435-11-9), with molecular formula C25H26N4O4 and molecular weight 446.20 g/mol. IUPAC: 6-tert-butyl-N-[1-(3-cyanopropyl)-2-hydroxyindol-3-yl]imino-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide
Property Insights of 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide
The XLogP value of 5.39848 indicates that 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide. Following Lipinski's Rule of Five, 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide?
The CAS number of 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide is 355435-11-9.
What is the molecular formula of 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide?
The molecular formula of 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide is C25H26N4O4.
What is the molecular weight of 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide?
The molecular weight of 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide is 446.20 g/mol.
Where can I buy 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide?
You can request a quote for 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 7-tert-butyl-N'-[(3E)-1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.