4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol
TL;DR: 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol (CAS 478255-63-9) is a chemical compound with molecular formula C24H22N4O2S and molecular weight 430.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-(3-methoxy-4-phenylmethoxyphenyl)methylideneamino]-3-(3-methylphenyl)-1H-1,2,4-triazole-5-thione
Also Known As: 4-((4-(Benzyloxy)-3-methoxybenzylidene)amino)-3-(m-tolyl)-1H-1,2,4-triazole-5(4H)-thione, 4-((4-(BENZYLOXY)-3-MEO-BENZYLIDENE)AMINO)-5-(3-ME-PH)-4H-1,2,4-TRIAZOLE-3-THIOL, (E)-4-((4-(benzyloxy)-3-methoxybenzylidene)amino)-5-(m-tolyl)-4H-1,2,4-triazole-3-thiol, 4-({(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}amino)-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione, 4-[(E)-(3-methoxy-4-phenylmethoxyphenyl)methylideneamino]-3-(3-methylphenyl)-1H-1,2,4-triazole-5-thione
| Molecular Formula | C24H22N4O2S |
|---|---|
| Molecular Weight | 430.15 g/mol |
| LogP | 5.38591 |
| Topological Polar Surface Area | 64.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 430.14636 |
| Heavy Atoms | 31 |
| Complexity | 1262.0719 |
Chemical Identifiers
| CAS Number | 478255-63-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=NNC(=S)N2/N=C/C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC |
Product Overview
4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol (CAS 478255-63-9), with molecular formula C24H22N4O2S and molecular weight 430.15 g/mol. IUPAC: 4-[(E)-(3-methoxy-4-phenylmethoxyphenyl)methylideneamino]-3-(3-methylphenyl)-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol
Property Insights of 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol
The XLogP value of 5.38591 indicates that 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol. Following Lipinski's Rule of Five, 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol?
The CAS number of 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol is 478255-63-9.
What is the molecular formula of 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol?
The molecular formula of 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol is C24H22N4O2S.
What is the molecular weight of 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol?
The molecular weight of 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol is 430.15 g/mol.
Where can I buy 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol?
You can request a quote for 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol?
Yes, KEHONG BIO provides custom synthesis services for 4-((4-(Benzyloxy)-3-meo-benzylidene)amino)-5-(3-ME-PH)-4H-1,2,4-triazole-3-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.