5E-508
TL;DR: 5E-508 (CAS 400082-71-5) is a chemical compound with molecular formula C20H12F4N2O4 and molecular weight 420.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2,2-difluoro-1,3-benzodioxol-5-yl)methyl]-N-(2,4-difluorophenyl)-2-oxopyridine-3-carboxamide
Also Known As: 5E-508, 1-[(2,2-difluoro-1,3-benzodioxol-5-yl)methyl]-N-(2,4-difluorophenyl)-2-oxo-1,2-dihydro-3-pyridinecarboxamide, 1-[(2,2-difluoro-1,3-benzodioxol-5-yl)methyl]-N-(2,4-difluorophenyl)-2-oxopyridine-3-carboxamide, 1-[(2,2-difluoro-2H-1,3-benzodioxol-5-yl)methyl]-N-(2,4-difluorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxamide, 1-[(2,2-difluorobenzo[1,3]dioxol-5-yl)methyl]-N-(2,4-difluorophenyl)-2-oxo-pyridine-3-carboxamide
| Molecular Formula | C20H12F4N2O4 |
|---|---|
| Molecular Weight | 420.07 g/mol |
| LogP | 3.7486 |
| Topological Polar Surface Area | 69.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.07333 |
| Heavy Atoms | 30 |
| Complexity | 1209.6511 |
Chemical Identifiers
| CAS Number | 400082-71-5 |
|---|---|
| SMILES | C1=CN(C(=O)C(=C1)C(=O)NC2=C(C=C(C=C2)F)F)CC3=CC4=C(C=C3)OC(O4)(F)F |
Product Overview
5E-508 (CAS 400082-71-5), with molecular formula C20H12F4N2O4 and molecular weight 420.07 g/mol. IUPAC: 1-[(2,2-difluoro-1,3-benzodioxol-5-yl)methyl]-N-(2,4-difluorophenyl)-2-oxopyridine-3-carboxamide.
Chemical Property Profile of 5E-508
Property Insights of 5E-508
The XLogP value of 3.7486 indicates that 5E-508 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 5E-508. Following Lipinski's Rule of Five, 5E-508 has 1 hydrogen bond donor(s) and 4 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-508?
The CAS number of 5E-508 is 400082-71-5.
What is the molecular formula of 5E-508?
The molecular formula of 5E-508 is C20H12F4N2O4.
What is the molecular weight of 5E-508?
The molecular weight of 5E-508 is 420.07 g/mol.
Where can I buy 5E-508?
You can request a quote for 5E-508 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5E-508?
Yes, KEHONG BIO provides custom synthesis services for 5E-508 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.