![(E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine structure](/static/products/828/828282-08-2.png)
(E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine
TL;DR: (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine (CAS 828282-08-2) is a chemical compound with molecular formula C18H18F2N4O2S and molecular weight 392.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine
Also Known As: (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine, 3-(difluoromethyl)-N-[(E)-{5-[(3,5-dimethylphenoxy)methyl]furan-2-yl}methylidene]-5-(methylsulfanyl)-4H-1,2,4-triazol-4-amine, N-[3-(DIFLUOROMETHYL)-5-(METHYLSULFANYL)-4H-1,2,4-TRIAZOL-4-YL]-N-((E)-1-{5-[(3,5-DIMETHYLPHENOXY)METHYL]-2-FURYL}METHYLIDENE)AMINE
| Molecular Formula | C18H18F2N4O2S |
|---|---|
| Molecular Weight | 392.11 g/mol |
| LogP | 4.60864 |
| Topological Polar Surface Area | 65.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 392.11185 |
| Heavy Atoms | 27 |
| Complexity | 932.49225 |
Chemical Identifiers
| CAS Number | 828282-08-2 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OCC2=CC=C(O2)/C=N/N3C(=NN=C3SC)C(F)F)C |
Product Overview
(E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine (CAS 828282-08-2), with molecular formula C18H18F2N4O2S and molecular weight 392.11 g/mol. IUPAC: (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine.
Chemical Property Profile of (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine
Property Insights of (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine
The XLogP value of 4.60864 indicates that (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.44 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine. Following Lipinski's Rule of Five, (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine has 0 hydrogen bond donor(s) and 6 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 (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine?
The CAS number of (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine is 828282-08-2.
What is the molecular formula of (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine?
The molecular formula of (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine is C18H18F2N4O2S.
What is the molecular weight of (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine?
The molecular weight of (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine is 392.11 g/mol.
Where can I buy (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine?
You can request a quote for (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-[3-(difluoromethyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]methanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.