![[[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate structure](/static/products/3390/339014-83-4.webp)
[[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate
TL;DR: [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate (CAS 339014-83-4) is a chemical compound with molecular formula C21H12F3N3O3 and molecular weight 411.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[6-(4-cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate
Also Known As: [[6-(4-cyanophenoxy)pyridin-3-yl]methylideneamino] 3-(trifluoromethyl)benzoate, 4-({5-[({[3-(trifluoromethyl)benzoyl]oxy}imino)methyl]-2-pyridinyl}oxy)benzenecarbonitrile
| Molecular Formula | C21H12F3N3O3 |
|---|---|
| Molecular Weight | 411.08 g/mol |
| LogP | 4.95528 |
| Topological Polar Surface Area | 84.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.08307 |
| Heavy Atoms | 30 |
| Complexity | 1103.3259 |
Chemical Identifiers
| CAS Number | 339014-83-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C(=O)ON=CC2=CN=C(C=C2)OC3=CC=C(C=C3)C#N |
Product Overview
[[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate (CAS 339014-83-4), with molecular formula C21H12F3N3O3 and molecular weight 411.08 g/mol. IUPAC: [[6-(4-cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate.
Chemical Property Profile of [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate
Property Insights of [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate
The XLogP value of 4.95528 indicates that [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.57 Ų falls within the moderate polarity range, balancing permeability and solubility for [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate. Following Lipinski's Rule of Five, [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate has 0 hydrogen bond donor(s) and 6 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 [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate?
The CAS number of [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate is 339014-83-4.
What is the molecular formula of [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate?
The molecular formula of [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate is C21H12F3N3O3.
What is the molecular weight of [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate?
The molecular weight of [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate is 411.08 g/mol.
Where can I buy [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate?
You can request a quote for [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for [[6-(4-Cyanophenoxy)-3-pyridinyl]methylideneamino] 3-(trifluoromethyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.