2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide
TL;DR: 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide (CAS 680213-89-2) is a chemical compound with molecular formula C14H8Cl3F3N2O and molecular weight 381.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[(2,6-dichlorophenyl)methyl]-4-(trifluoromethyl)pyridine-3-carboxamide
Also Known As: 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide, 2-chloro-N-[(2,6-dichlorophenyl)methyl]-4-(trifluoromethyl)pyridine-3-carboxamide
| Molecular Formula | C14H8Cl3F3N2O |
|---|---|
| Molecular Weight | 381.97 g/mol |
| LogP | 4.9906 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 381.96542 |
| Heavy Atoms | 23 |
| Complexity | 730.2827 |
Chemical Identifiers
| CAS Number | 680213-89-2 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)CNC(=O)C2=C(C=CN=C2Cl)C(F)(F)F)Cl |
Product Overview
2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide (CAS 680213-89-2), with molecular formula C14H8Cl3F3N2O and molecular weight 381.97 g/mol. IUPAC: 2-chloro-N-[(2,6-dichlorophenyl)methyl]-4-(trifluoromethyl)pyridine-3-carboxamide.
Chemical Property Profile of 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide
Property Insights of 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide
The XLogP value of 4.9906 indicates that 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide 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 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide?
The CAS number of 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide is 680213-89-2.
What is the molecular formula of 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide?
The molecular formula of 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide is C14H8Cl3F3N2O.
What is the molecular weight of 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide?
The molecular weight of 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide is 381.97 g/mol.
Where can I buy 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide?
You can request a quote for 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(2,6-dichlorobenzyl)-4-(trifluoromethyl)nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.