![1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene structure](/static/products/861/861148-31-4.png)
1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene
TL;DR: 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene (CAS 861148-31-4) is a chemical compound with molecular formula C19H20ClN3OS and molecular weight 373.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-chlorophenyl)methylsulfanyl]-4-ethyl-5-[(4-methylphenoxy)methyl]-1,2,4-triazole
Also Known As: 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene, 3-((3-chlorobenzyl)thio)-4-ethyl-5-((p-tolyloxy)methyl)-4H-1,2,4-triazole, 3-[(3-chlorobenzyl)sulfanyl]-4-ethyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazole, 3-[(3-chlorophenyl)methylsulfanyl]-4-ethyl-5-[(4-methylphenoxy)methyl]-1,2,4-triazole, 3-{[(3-chlorophenyl)methyl]sulfanyl}-4-ethyl-5-(4-methylphenoxymethyl)-4H-1,2,4-triazole
| Molecular Formula | C19H20ClN3OS |
|---|---|
| Molecular Weight | 373.10 g/mol |
| LogP | 5.13112 |
| Topological Polar Surface Area | 39.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 373.10156 |
| Heavy Atoms | 25 |
| Complexity | 832.94055 |
Chemical Identifiers
| CAS Number | 861148-31-4 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC2=CC(=CC=C2)Cl)COC3=CC=C(C=C3)C |
Product Overview
1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene (CAS 861148-31-4), with molecular formula C19H20ClN3OS and molecular weight 373.10 g/mol. IUPAC: 3-[(3-chlorophenyl)methylsulfanyl]-4-ethyl-5-[(4-methylphenoxy)methyl]-1,2,4-triazole.
Chemical Property Profile of 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene
Property Insights of 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene
The XLogP value of 5.13112 indicates that 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.94 Ų, 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene?
The CAS number of 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene is 861148-31-4.
What is the molecular formula of 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene?
The molecular formula of 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene is C19H20ClN3OS.
What is the molecular weight of 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene?
The molecular weight of 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene is 373.10 g/mol.
Where can I buy 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene?
You can request a quote for 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-({5-[(3-chlorophenyl)methylthio]-4-ethyl(1,2,4-triazol-3-yl)}methoxy)-4-meth ylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.