![5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole structure](/static/products/1887/188754-00-9.webp)
5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole
TL;DR: 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole (CAS 188754-00-9) is a chemical compound with molecular formula C9H9BrN4S and molecular weight 283.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-bromoethylsulfanyl)-1-phenyltetrazole
Also Known As: 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole, 5-(2-bromoethylsulfanyl)-1-phenyltetrazole, 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetrazole, 2-bromo-1-(1-phenyl(1,2,3,4-tetraazol-5-ylthio))ethane, A1988/0083586
| Molecular Formula | C9H9BrN4S |
|---|---|
| Molecular Weight | 283.97 g/mol |
| LogP | 2.1493 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.97314 |
| Heavy Atoms | 15 |
| Complexity | 417.06052 |
Chemical Identifiers
| CAS Number | 188754-00-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=N2)SCCBr |
Product Overview
5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole (CAS 188754-00-9), with molecular formula C9H9BrN4S and molecular weight 283.97 g/mol. IUPAC: 5-(2-bromoethylsulfanyl)-1-phenyltetrazole.
Chemical Property Profile of 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole
Property Insights of 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole
The XLogP value of 2.1493 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole. With a topological polar surface area (TPSA) of 43.6 Ų, 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole has 0 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-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole?
The CAS number of 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole is 188754-00-9.
What is the molecular formula of 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole?
The molecular formula of 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole is C9H9BrN4S.
What is the molecular weight of 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole?
The molecular weight of 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole is 283.97 g/mol.
Where can I buy 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole?
You can request a quote for 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2-bromoethyl)sulfanyl]-1-phenyl-1H-tetraazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.