![3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine structure](/static/products/577/577990-17-1.png)
3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine
TL;DR: 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine (CAS 577990-17-1) is a chemical compound with molecular formula C20H14Br2N4S and molecular weight 499.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(4-bromophenyl)-5-[(3-bromophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine
Also Known As: 3-[4-(4-bromophenyl)-5-[(3-bromophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine, 3-(5-((3-bromobenzyl)thio)-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl)pyridine, 3-[4-(4-bromophenyl)-5-{[(3-bromophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]pyridine, 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine
| Molecular Formula | C20H14Br2N4S |
|---|---|
| Molecular Weight | 499.93 g/mol |
| LogP | 6.1466 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 499.9306 |
| Heavy Atoms | 27 |
| Complexity | 1049.287 |
Chemical Identifiers
| CAS Number | 577990-17-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)CSC2=NN=C(N2C3=CC=C(C=C3)Br)C4=CN=CC=C4 |
Product Overview
3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine (CAS 577990-17-1), with molecular formula C20H14Br2N4S and molecular weight 499.93 g/mol. IUPAC: 3-[4-(4-bromophenyl)-5-[(3-bromophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine.
Chemical Property Profile of 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine
Property Insights of 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine
The XLogP value of 6.1466 indicates that 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.6 Ų, 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine?
The CAS number of 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine is 577990-17-1.
What is the molecular formula of 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine?
The molecular formula of 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine is C20H14Br2N4S.
What is the molecular weight of 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine?
The molecular weight of 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine is 499.93 g/mol.
Where can I buy 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine?
You can request a quote for 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine?
Yes, KEHONG BIO provides custom synthesis services for 3-{5-[(3-bromobenzyl)sulfanyl]-4-(4-bromophenyl)-4H-1,2,4-triazol-3-yl}pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.