![3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione structure](/static/products/133/133846-99-8.png)
3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione
TL;DR: 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione (CAS 133846-99-8) is a chemical compound with molecular formula C12H9N5S2 and molecular weight 287.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione
Also Known As: 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione, AO-476/40829177, 5-(4-pyridinyl)-4-[(2-thienylmethylene)amino]-2,4-dihydro-3H-1,2,4-triazole-3-thione, (E)-5-(pyridin-4-yl)-4-((thiophen-2-ylmethylene)amino)-4H-1,2,4-triazole-3-thiol, 4-((1E)-2-(2-thienyl)-1-azavinyl)-5-(4-pyridyl)-1,2,4-triazole-3-thiol
| Molecular Formula | C12H9N5S2 |
|---|---|
| Molecular Weight | 287.03 g/mol |
| LogP | 2.94639 |
| Topological Polar Surface Area | 58.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.02994 |
| Heavy Atoms | 19 |
| Complexity | 740.03503 |
Chemical Identifiers
| CAS Number | 133846-99-8 |
|---|---|
| SMILES | C1=CSC(=C1)/C=N/N2C(=NNC2=S)C3=CC=NC=C3 |
Product Overview
3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione (CAS 133846-99-8), with molecular formula C12H9N5S2 and molecular weight 287.03 g/mol. IUPAC: 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione
Property Insights of 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione
The XLogP value of 2.94639 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione. With a topological polar surface area (TPSA) of 58.86 Ų, 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione has 1 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 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione?
The CAS number of 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione is 133846-99-8.
What is the molecular formula of 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione?
The molecular formula of 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione is C12H9N5S2.
What is the molecular weight of 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione?
The molecular weight of 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione is 287.03 g/mol.
Where can I buy 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione?
You can request a quote for 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-pyridin-4-yl-4-[(E)-thiophen-2-ylmethylideneamino]-1H-1,2,4-triazole-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.