J2.045.011H
TL;DR: J2.045.011H (CAS 210230-99-2) is a chemical compound with molecular formula C20H19F3N4O3 and molecular weight 420.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methoxy-2-methyl-4-[2-[[(E)-1-[3-(trifluoromethyl)phenyl]ethylideneamino]oxymethyl]phenyl]-1,2,4-triazol-3-one
Also Known As: J2.045.011H, 2,4-Dihydro-5-methoxy-2-methyl-4-(2-((((E)-(1-(3-(trifluoromethyl)phenyl)ethylidene)amino)oxy)methyl)phenyl)-3H-1,2,4-triazol-3-one, (E)-2,4-Dihydro-5-methoxy-2-methyl-4-(2-((((1-(3-(trifluoromethyl)phenyl)ethylidene)amino)oxy)methyl)-phenyl)-3H-1,2,4-triazol-3-one, 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-methoxy-2-methyl-4-(2-((((E)-(1-(3-(trifluoromethyl)phenyl)ethylidene)amino)oxy)methyl)phenyl)-, 2,4-Dihydro-5-methoxy-2-methyl-4-[2-[[[(E)-[1-[3-(trifluoromethyl)phenyl]ethylidene]amino]oxy]methyl]phenyl]-3H-1,2,4-triazol-3-one
| Molecular Formula | C20H19F3N4O3 |
|---|---|
| Molecular Weight | 420.14 g/mol |
| LogP | 3.5392 |
| Topological Polar Surface Area | 70.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.14093 |
| Heavy Atoms | 30 |
| Complexity | 1132.8108 |
Chemical Identifiers
| CAS Number | 210230-99-2 |
|---|---|
| SMILES | C/C(=N\OCC1=CC=CC=C1N2C(=NN(C2=O)C)OC)/C3=CC(=CC=C3)C(F)(F)F |
Product Overview
J2.045.011H (CAS 210230-99-2), with molecular formula C20H19F3N4O3 and molecular weight 420.14 g/mol. IUPAC: 5-methoxy-2-methyl-4-[2-[[(E)-1-[3-(trifluoromethyl)phenyl]ethylideneamino]oxymethyl]phenyl]-1,2,4-triazol-3-one.
Chemical Property Profile of J2.045.011H
Property Insights of J2.045.011H
The XLogP value of 3.5392 indicates that J2.045.011H is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.64 Ų falls within the moderate polarity range, balancing permeability and solubility for J2.045.011H. Following Lipinski's Rule of Five, J2.045.011H has 0 hydrogen bond donor(s) and 5 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 J2.045.011H?
The CAS number of J2.045.011H is 210230-99-2.
What is the molecular formula of J2.045.011H?
The molecular formula of J2.045.011H is C20H19F3N4O3.
What is the molecular weight of J2.045.011H?
The molecular weight of J2.045.011H is 420.14 g/mol.
Where can I buy J2.045.011H?
You can request a quote for J2.045.011H directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J2.045.011H?
Yes, KEHONG BIO provides custom synthesis services for J2.045.011H and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.