7E-311S
TL;DR: 7E-311S (CAS 339008-64-9) is a chemical compound with molecular formula C20H13Cl2F3N2O3 and molecular weight 456.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2,6-dichlorophenyl)methyl]-6-oxo-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
Also Known As: 7E-311S, 1-(2,6-dichlorobenzyl)-6-oxo-N-[4-(trifluoromethoxy)phenyl]-1,6-dihydro-3-pyridinecarboxamide, 1-[(2,6-dichlorophenyl)methyl]-6-oxo-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide, 1-[(2,6-dichlorophenyl)methyl]-6-oxo-N-[4-(trifluoromethoxy)phenyl]-1,6-dihydropyridine-3-carboxamide
| Molecular Formula | C20H13Cl2F3N2O3 |
|---|---|
| Molecular Weight | 456.03 g/mol |
| LogP | 5.3543 |
| Topological Polar Surface Area | 60.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 456.02554 |
| Heavy Atoms | 30 |
| Complexity | 1109.126 |
Chemical Identifiers
| CAS Number | 339008-64-9 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)CN2C=C(C=CC2=O)C(=O)NC3=CC=C(C=C3)OC(F)(F)F)Cl |
Product Overview
7E-311S (CAS 339008-64-9), with molecular formula C20H13Cl2F3N2O3 and molecular weight 456.03 g/mol. IUPAC: 1-[(2,6-dichlorophenyl)methyl]-6-oxo-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide.
Chemical Property Profile of 7E-311S
Property Insights of 7E-311S
The XLogP value of 5.3543 indicates that 7E-311S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 7E-311S. Following Lipinski's Rule of Five, 7E-311S has 1 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 7E-311S?
The CAS number of 7E-311S is 339008-64-9.
What is the molecular formula of 7E-311S?
The molecular formula of 7E-311S is C20H13Cl2F3N2O3.
What is the molecular weight of 7E-311S?
The molecular weight of 7E-311S is 456.03 g/mol.
Where can I buy 7E-311S?
You can request a quote for 7E-311S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7E-311S?
Yes, KEHONG BIO provides custom synthesis services for 7E-311S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.