7-tert-butyl-N'-[(3E)-1-(naphthalen-1-ylmethyl)-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-(naphthalen-1-ylmethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide (CAS 330836-28-7) is a chemical compound with molecular formula C32H29N3O4 and molecular weight 519.22 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-(naphthalen-1-ylmethyl)indol-3-yl]imino-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: 7-tert-butyl-N'-[(3E)-1-(naphthalen-1-ylmethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide, (E)-7-(tert-butyl)-N'-(1-(naphthalen-1-ylmethyl)-2-oxoindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide, 6-tert-butyl-N-[(Z)-[1-(naphthalen-1-ylmethyl)-2-oxoindol-3-ylidene]amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide, 6-tert-butyl-N-[[1-(naphthalen-1-ylmethyl)-2-oxoindol-3-ylidene]amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide, 7-TERT-BUTYL-N'-[(3E)-1-(NAPHTHALEN-1-YLMETHYL)-2-OXOINDOL-3-YLIDENE]-2,3-DIHYDRO-1,4-BENZODIOXINE-2-CARBOHYDRAZIDE
| Molecular Formula | C32H29N3O4 |
|---|---|
| Molecular Weight | 519.22 g/mol |
| LogP | 7.2962 |
| Topological Polar Surface Area | 85.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 519.2158 |
| Heavy Atoms | 39 |
| Complexity | 1741.0308 |
Chemical Identifiers
| CAS Number | 330836-28-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC2=C(C=C1)OCC(O2)C(=O)N=NC3=C(N(C4=CC=CC=C43)CC5=CC=CC6=CC=CC=C65)O |
Product Overview
7-tert-butyl-N'-[(3E)-1-(naphthalen-1-ylmethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide (CAS 330836-28-7), with molecular formula C32H29N3O4 and molecular weight 519.22 g/mol. IUPAC: 6-tert-butyl-N-[2-hydroxy-1-(naphthalen-1-ylmethyl)indol-3-yl]imino-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of 7-tert-butyl-N'-[(3E)-1-(naphthalen-1-ylmethyl)-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-(naphthalen-1-ylmethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide
The XLogP value of 7.2962 indicates that 7-tert-butyl-N'-[(3E)-1-(naphthalen-1-ylmethyl)-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 85.41 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-tert-butyl-N'-[(3E)-1-(naphthalen-1-ylmethyl)-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-(naphthalen-1-ylmethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-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 7-tert-butyl-N'-[(3E)-1-(naphthalen-1-ylmethyl)-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-(naphthalen-1-ylmethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide is 330836-28-7.
What is the molecular formula of 7-tert-butyl-N'-[(3E)-1-(naphthalen-1-ylmethyl)-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-(naphthalen-1-ylmethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide is C32H29N3O4.
What is the molecular weight of 7-tert-butyl-N'-[(3E)-1-(naphthalen-1-ylmethyl)-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-(naphthalen-1-ylmethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide is 519.22 g/mol.
Where can I buy 7-tert-butyl-N'-[(3E)-1-(naphthalen-1-ylmethyl)-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-(naphthalen-1-ylmethyl)-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-(naphthalen-1-ylmethyl)-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-(naphthalen-1-ylmethyl)-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.