(Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide
TL;DR: (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide (CAS 384358-31-0) is a chemical compound with molecular formula C20H20ClFN2O3 and molecular weight 390.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-tert-butyl-N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide, 6-tert-butyl-N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide, 7-tert-butyl-N'-[(Z)-(2-chloro-6-fluorophenyl)methylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide
| Molecular Formula | C20H20ClFN2O3 |
|---|---|
| Molecular Weight | 390.11 g/mol |
| LogP | 4.0667 |
| Topological Polar Surface Area | 59.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.11465 |
| Heavy Atoms | 27 |
| Complexity | 873.03094 |
Chemical Identifiers
| CAS Number | 384358-31-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC2=C(C=C1)OCC(O2)C(=O)N/N=C\C3=C(C=CC=C3Cl)F |
Product Overview
(Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide (CAS 384358-31-0), with molecular formula C20H20ClFN2O3 and molecular weight 390.11 g/mol. IUPAC: 6-tert-butyl-N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide
Property Insights of (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide
The XLogP value of 4.0667 indicates that (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.92 Ų, (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide has 1 hydrogen bond donor(s) and 4 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 (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
The CAS number of (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is 384358-31-0.
What is the molecular formula of (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
The molecular formula of (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is C20H20ClFN2O3.
What is the molecular weight of (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
The molecular weight of (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is 390.11 g/mol.
Where can I buy (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
You can request a quote for (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-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 (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-7-(tert-butyl)-N'-(2-chloro-6-fluorobenzylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.