5E-344S
TL;DR: 5E-344S (CAS 338754-72-6) is a chemical compound with molecular formula C20H14ClF3N2O2 and molecular weight 406.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide
Also Known As: 5E-344S, N-(4-chlorophenyl)-2-oxo-1-[3-(trifluoromethyl)benzyl]-1,2-dihydro-3-pyridinecarboxamide, N-(4-chlorophenyl)-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide, N-(4-chlorophenyl)-2-oxo-1-{[3-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide, N-(4-chlorophenyl)-2-oxo-1-{[3-(trifluoromethyl)phenyl]methyl}pyridine-3-carboxamide
| Molecular Formula | C20H14ClF3N2O2 |
|---|---|
| Molecular Weight | 406.07 g/mol |
| LogP | 4.8211 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 406.06958 |
| Heavy Atoms | 28 |
| Complexity | 1060.0363 |
Chemical Identifiers
| CAS Number | 338754-72-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)CN2C=CC=C(C2=O)C(=O)NC3=CC=C(C=C3)Cl |
Product Overview
5E-344S (CAS 338754-72-6), with molecular formula C20H14ClF3N2O2 and molecular weight 406.07 g/mol. IUPAC: N-(4-chlorophenyl)-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide.
Chemical Property Profile of 5E-344S
Property Insights of 5E-344S
The XLogP value of 4.8211 indicates that 5E-344S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.1 Ų, 5E-344S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5E-344S 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 5E-344S?
The CAS number of 5E-344S is 338754-72-6.
What is the molecular formula of 5E-344S?
The molecular formula of 5E-344S is C20H14ClF3N2O2.
What is the molecular weight of 5E-344S?
The molecular weight of 5E-344S is 406.07 g/mol.
Where can I buy 5E-344S?
You can request a quote for 5E-344S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5E-344S?
Yes, KEHONG BIO provides custom synthesis services for 5E-344S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.