2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate
TL;DR: 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate (CAS 1025159-81-2) is a chemical compound with molecular formula C23H20F3N3O6 and molecular weight 491.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[amino-[4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]methylidene]amino] 3,4,5-trimethoxybenzoate
Also Known As: 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate, [[amino-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]methylidene]amino] 3,4,5-trimethoxybenzoate, [[amino-[4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenyl]methylene]amino] 3,4,5-trimethoxybenzoate, C23H20F3N3O6
| Molecular Formula | C23H20F3N3O6 |
|---|---|
| Molecular Weight | 491.13 g/mol |
| LogP | 4.3958 |
| Topological Polar Surface Area | 114.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 491.13043 |
| Heavy Atoms | 35 |
| Complexity | 1187.6616 |
Chemical Identifiers
| CAS Number | 1025159-81-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)ON=C(C2=CC=C(C=C2)OC3=NC=C(C=C3)C(F)(F)F)N |
Product Overview
2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate (CAS 1025159-81-2), with molecular formula C23H20F3N3O6 and molecular weight 491.13 g/mol. IUPAC: [[amino-[4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]methylidene]amino] 3,4,5-trimethoxybenzoate.
Chemical Property Profile of 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate
Property Insights of 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate
The XLogP value of 4.3958 indicates that 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate. Following Lipinski's Rule of Five, 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate has 1 hydrogen bond donor(s) and 8 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 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate?
The CAS number of 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate is 1025159-81-2.
What is the molecular formula of 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate?
The molecular formula of 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate is C23H20F3N3O6.
What is the molecular weight of 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate?
The molecular weight of 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate is 491.13 g/mol.
Where can I buy 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate?
You can request a quote for 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-1-aza-2-(4-(5-(trifluoromethyl)(2-pyridyloxy))phenyl)vinyl3,4,5-trimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.