6E-317S
TL;DR: 6E-317S (CAS 338781-71-8) is a chemical compound with molecular formula C20H13F5N2O2 and molecular weight 408.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-difluorophenyl)-2-oxo-1-[[4-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide
Also Known As: 6E-317S, F2743-2046, N-(2,4-difluorophenyl)-2-oxo-1-{[4-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide, N-(2,4-difluorophenyl)-2-oxo-1-[[4-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide, N-(2,4-difluorophenyl)-2-oxo-1-[4-(trifluoromethyl)benzyl]-1,2-dihydro-3-pyridinecarboxamide
| Molecular Formula | C20H13F5N2O2 |
|---|---|
| Molecular Weight | 408.09 g/mol |
| LogP | 4.4459 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 408.08972 |
| Heavy Atoms | 29 |
| Complexity | 1105.0898 |
Chemical Identifiers
| CAS Number | 338781-71-8 |
|---|---|
| SMILES | C1=CN(C(=O)C(=C1)C(=O)NC2=C(C=C(C=C2)F)F)CC3=CC=C(C=C3)C(F)(F)F |
Product Overview
6E-317S (CAS 338781-71-8), with molecular formula C20H13F5N2O2 and molecular weight 408.09 g/mol. IUPAC: N-(2,4-difluorophenyl)-2-oxo-1-[[4-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide.
Chemical Property Profile of 6E-317S
Property Insights of 6E-317S
The XLogP value of 4.4459 indicates that 6E-317S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.1 Ų, 6E-317S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6E-317S has 1 hydrogen bond donor(s) and 2 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 6E-317S?
The CAS number of 6E-317S is 338781-71-8.
What is the molecular formula of 6E-317S?
The molecular formula of 6E-317S is C20H13F5N2O2.
What is the molecular weight of 6E-317S?
The molecular weight of 6E-317S is 408.09 g/mol.
Where can I buy 6E-317S?
You can request a quote for 6E-317S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6E-317S?
Yes, KEHONG BIO provides custom synthesis services for 6E-317S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.