![N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide structure](/static/products/6221/6221-86-9.webp)
N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide
TL;DR: N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide (CAS 6221-86-9) is a chemical compound with molecular formula C16H11BrClN3O6 and molecular weight 454.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitrophenoxy)acetamide
Also Known As: N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide, N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitrophenoxy)acetamide, N'-[(6-Bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-(4-chloro-2-nitrophenoxy)acetohydrazide
| Molecular Formula | C16H11BrClN3O6 |
|---|---|
| Molecular Weight | 454.95 g/mol |
| LogP | 3.2685 |
| Topological Polar Surface Area | 112.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 454.95197 |
| Heavy Atoms | 27 |
| Complexity | 936.6119 |
Chemical Identifiers
| CAS Number | 6221-86-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)COC3=C(C=C(C=C3)Cl)[N+](=O)[O-])Br |
Product Overview
N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide (CAS 6221-86-9), with molecular formula C16H11BrClN3O6 and molecular weight 454.95 g/mol. IUPAC: N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitrophenoxy)acetamide.
Chemical Property Profile of N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide
Property Insights of N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide
The XLogP value of 3.2685 indicates that N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.29 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide. Following Lipinski's Rule of Five, N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide has 1 hydrogen bond donor(s) and 7 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 N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide?
The CAS number of N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide is 6221-86-9.
What is the molecular formula of N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide?
The molecular formula of N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide is C16H11BrClN3O6.
What is the molecular weight of N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide?
The molecular weight of N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide is 454.95 g/mol.
Where can I buy N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide?
You can request a quote for N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(6-bromobenzo[1,3]dioxol-5-yl)methylideneamino]-2-(4-chloro-2-nitro-phenoxy)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.