5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol
TL;DR: 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol (CAS 478255-58-2) is a chemical compound with molecular formula C15H14N4S2 and molecular weight 314.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-methylphenyl)-4-[(E)-(3-methylthiophen-2-yl)methylideneamino]-1H-1,2,4-triazole-5-thione
Also Known As: Salor-int l230340-1ea, 4-(((3-Methylthiophen-2-yl)methylene)amino)-3-(m-tolyl)-1H-1,2,4-triazole-5(4H)-thione, 5-(3-ME-PHENYL)-4-(((3-ME-2-THIENYL)METHYLENE)AMINO)-4H-1,2,4-TRIAZOLE-3-THIOL, (E)-4-(((3-methylthiophen-2-yl)methylene)amino)-5-(m-tolyl)-4H-1,2,4-triazole-3-thiol, 4-[(1E)-2-(3-methyl(2-thienyl))-1-azavinyl]-5-(3-methylphenyl)-1,2,4-triazole- 3-thiol
| Molecular Formula | C15H14N4S2 |
|---|---|
| Molecular Weight | 314.07 g/mol |
| LogP | 4.16823 |
| Topological Polar Surface Area | 45.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.06598 |
| Heavy Atoms | 21 |
| Complexity | 854.43835 |
Chemical Identifiers
| CAS Number | 478255-58-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=NNC(=S)N2/N=C/C3=C(C=CS3)C |
Product Overview
5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol (CAS 478255-58-2), with molecular formula C15H14N4S2 and molecular weight 314.07 g/mol. IUPAC: 3-(3-methylphenyl)-4-[(E)-(3-methylthiophen-2-yl)methylideneamino]-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol
Property Insights of 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol
The XLogP value of 4.16823 indicates that 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.97 Ų, 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol has 1 hydrogen bond donor(s) and 4 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 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol?
The CAS number of 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol is 478255-58-2.
What is the molecular formula of 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol?
The molecular formula of 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol is C15H14N4S2.
What is the molecular weight of 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol?
The molecular weight of 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol is 314.07 g/mol.
Where can I buy 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol?
You can request a quote for 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-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 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol?
Yes, KEHONG BIO provides custom synthesis services for 5-(3-ME-Phenyl)-4-(((3-ME-2-thienyl)methylene)amino)-4H-1,2,4-triazole-3-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.