![({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene structure](/static/products/714/714933-47-8.png)
({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene
TL;DR: ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene (CAS 714933-47-8) is a chemical compound with molecular formula C18H18N4O3S and molecular weight 370.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethyl-3-[(4-nitrophenyl)methylsulfanyl]-5-(phenoxymethyl)-1,2,4-triazole
Also Known As: 4-ethyl-3-((4-nitrobenzyl)thio)-5-(phenoxymethyl)-4H-1,2,4-triazole, 4-ethyl-3-[(4-nitrobenzyl)sulfanyl]-5-(phenoxymethyl)-4H-1,2,4-triazole, ({4-ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene, 4-ethyl-3-[(4-nitrophenyl)methylsulfanyl]-5-(phenoxymethyl)-1,2,4-triazole, 4-ethyl-3-{[(4-nitrophenyl)methyl]sulfanyl}-5-(phenoxymethyl)-4H-1,2,4-triazole
| Molecular Formula | C18H18N4O3S |
|---|---|
| Molecular Weight | 370.11 g/mol |
| LogP | 4.0775 |
| Topological Polar Surface Area | 83.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 370.10995 |
| Heavy Atoms | 26 |
| Complexity | 865.9025 |
Chemical Identifiers
| CAS Number | 714933-47-8 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC2=CC=C(C=C2)[N+](=O)[O-])COC3=CC=CC=C3 |
Product Overview
({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene (CAS 714933-47-8), with molecular formula C18H18N4O3S and molecular weight 370.11 g/mol. IUPAC: 4-ethyl-3-[(4-nitrophenyl)methylsulfanyl]-5-(phenoxymethyl)-1,2,4-triazole.
Chemical Property Profile of ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene
Property Insights of ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene
The XLogP value of 4.0775 indicates that ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.08 Ų falls within the moderate polarity range, balancing permeability and solubility for ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene. Following Lipinski's Rule of Five, ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene 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 ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene?
The CAS number of ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene is 714933-47-8.
What is the molecular formula of ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene?
The molecular formula of ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene is C18H18N4O3S.
What is the molecular weight of ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene?
The molecular weight of ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene is 370.11 g/mol.
Where can I buy ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene?
You can request a quote for ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene?
Yes, KEHONG BIO provides custom synthesis services for ({4-Ethyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-3-yl}methoxy)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.