3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole
TL;DR: 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole (CAS 892161-07-8) is a chemical compound with molecular formula C10H8N4S and molecular weight 216.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole
Also Known As: 1H-1,2,4-Triazole, 3-(1H-pyrrol-2-yl)-5-(2-thienyl)-, 3-pyrrol-2-ylidene-5-thiophen-2-yl-1,2-dihydro-1,2,4-triazole
| Molecular Formula | C10H8N4S |
|---|---|
| Molecular Weight | 216.05 g/mol |
| LogP | 2.5283 |
| Topological Polar Surface Area | 57.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.04697 |
| Heavy Atoms | 15 |
| Complexity | 487.01685 |
Chemical Identifiers
| CAS Number | 892161-07-8 |
|---|---|
| SMILES | C1=CNC(=C1)C2=NNC(=N2)C3=CC=CS3 |
Product Overview
3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole (CAS 892161-07-8), with molecular formula C10H8N4S and molecular weight 216.05 g/mol. IUPAC: 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole.
Chemical Property Profile of 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole
Property Insights of 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole
The XLogP value of 2.5283 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole. With a topological polar surface area (TPSA) of 57.36 Ų, 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole has 2 hydrogen bond donor(s) and 3 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-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole?
The CAS number of 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole is 892161-07-8.
What is the molecular formula of 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole?
The molecular formula of 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole is C10H8N4S.
What is the molecular weight of 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole?
The molecular weight of 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole is 216.05 g/mol.
Where can I buy 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole?
You can request a quote for 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole?
Yes, KEHONG BIO provides custom synthesis services for 3-(1H-pyrrol-2-yl)-5-thiophen-2-yl-1H-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.