8E-330S
TL;DR: 8E-330S (CAS 339024-19-0) is a chemical compound with molecular formula C15H12ClF3N2O2 and molecular weight 344.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-N-methyl-6-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide
Also Known As: 8E-330S, 5-chloro-N-methyl-6-oxo-1-[3-(trifluoromethyl)benzyl]-1,6-dihydro-3-pyridinecarboxamide, 5-chloro-N-methyl-6-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide, 5-Chloro-N-methyl-6-oxo-1-(3-(trifluoromethyl)benzyl)-1,6-dihydropyridine-3-carboxamide, 5-chloro-N-methyl-6-oxo-1-{[3-(trifluoromethyl)phenyl]methyl}-1,6-dihydropyridine-3-carboxamide
| Molecular Formula | C15H12ClF3N2O2 |
|---|---|
| Molecular Weight | 344.05 g/mol |
| LogP | 2.9284 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.05392 |
| Heavy Atoms | 23 |
| Complexity | 800.0395 |
Chemical Identifiers
| CAS Number | 339024-19-0 |
|---|---|
| SMILES | CNC(=O)C1=CN(C(=O)C(=C1)Cl)CC2=CC(=CC=C2)C(F)(F)F |
Product Overview
8E-330S (CAS 339024-19-0), with molecular formula C15H12ClF3N2O2 and molecular weight 344.05 g/mol. IUPAC: 5-chloro-N-methyl-6-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide.
Chemical Property Profile of 8E-330S
Property Insights of 8E-330S
The XLogP value of 2.9284 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8E-330S. With a topological polar surface area (TPSA) of 51.1 Ų, 8E-330S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8E-330S 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 8E-330S?
The CAS number of 8E-330S is 339024-19-0.
What is the molecular formula of 8E-330S?
The molecular formula of 8E-330S is C15H12ClF3N2O2.
What is the molecular weight of 8E-330S?
The molecular weight of 8E-330S is 344.05 g/mol.
Where can I buy 8E-330S?
You can request a quote for 8E-330S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8E-330S?
Yes, KEHONG BIO provides custom synthesis services for 8E-330S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.