4N-386S
TL;DR: 4N-386S (CAS 478043-49-1) is a chemical compound with molecular formula C19H8ClF5N2O and molecular weight 410.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-chlorophenyl)-2-(2,4-difluorophenoxy)-4-(trifluoromethyl)pyridine-3-carbonitrile
Also Known As: 4N-386S, 6-(4-chlorophenyl)-2-(2,4-difluorophenoxy)-4-(trifluoromethyl)pyridine-3-carbonitrile, 6-(4-chlorophenyl)-2-(2,4-difluorophenoxy)-4-(trifluoromethyl)nicotinonitrile
| Molecular Formula | C19H8ClF5N2O |
|---|---|
| Molecular Weight | 410.02 g/mol |
| LogP | 6.36298 |
| Topological Polar Surface Area | 45.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 410.02454 |
| Heavy Atoms | 28 |
| Complexity | 1075.4077 |
Chemical Identifiers
| CAS Number | 478043-49-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NC(=C(C(=C2)C(F)(F)F)C#N)OC3=C(C=C(C=C3)F)F)Cl |
Product Overview
4N-386S (CAS 478043-49-1), with molecular formula C19H8ClF5N2O and molecular weight 410.02 g/mol. IUPAC: 6-(4-chlorophenyl)-2-(2,4-difluorophenoxy)-4-(trifluoromethyl)pyridine-3-carbonitrile.
Chemical Property Profile of 4N-386S
Property Insights of 4N-386S
The XLogP value of 6.36298 indicates that 4N-386S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.91 Ų, 4N-386S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4N-386S has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4N-386S?
The CAS number of 4N-386S is 478043-49-1.
What is the molecular formula of 4N-386S?
The molecular formula of 4N-386S is C19H8ClF5N2O.
What is the molecular weight of 4N-386S?
The molecular weight of 4N-386S is 410.02 g/mol.
Where can I buy 4N-386S?
You can request a quote for 4N-386S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4N-386S?
Yes, KEHONG BIO provides custom synthesis services for 4N-386S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.