![1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine structure](/static/products/383/383384-91-6.png)
1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine
TL;DR: 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine (CAS 383384-91-6) is a chemical compound with molecular formula C21H12BrFN2O3 and molecular weight 438.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine
Also Known As: 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine, 1-(6-bromobenzo[1,3]dioxol-5-yl)-N-[2-(4-fluorophenyl)benzooxazol-5-yl]methanimine
| Molecular Formula | C21H12BrFN2O3 |
|---|---|
| Molecular Weight | 438.00 g/mol |
| LogP | 5.8757 |
| Topological Polar Surface Area | 56.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 438.00153 |
| Heavy Atoms | 28 |
| Complexity | 1218.5333 |
Chemical Identifiers
| CAS Number | 383384-91-6 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)C=NC3=CC4=C(C=C3)OC(=N4)C5=CC=C(C=C5)F)Br |
Product Overview
1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine (CAS 383384-91-6), with molecular formula C21H12BrFN2O3 and molecular weight 438.00 g/mol. IUPAC: 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine.
Chemical Property Profile of 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine
Property Insights of 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine
The XLogP value of 5.8757 indicates that 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.85 Ų, 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine has 0 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 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine?
The CAS number of 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine is 383384-91-6.
What is the molecular formula of 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine?
The molecular formula of 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine is C21H12BrFN2O3.
What is the molecular weight of 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine?
The molecular weight of 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine is 438.00 g/mol.
Where can I buy 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine?
You can request a quote for 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine?
Yes, KEHONG BIO provides custom synthesis services for 1-(6-bromo-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.