4-(4-Bromophenyl)-1,2,3-thiadiazole
TL;DR: 4-(4-Bromophenyl)-1,2,3-thiadiazole (CAS 5347-18-2) is a chemical compound with molecular formula C8H5BrN2S and molecular weight 239.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-bromophenyl)thiadiazole
Also Known As: 4-(4-Bromophenyl)-1,2,3-thiadiazole, 4-(4-bromophenyl)thiadiazole, 1-Phenoxy-2-propanol, Bionet2_000997, 1,2,3-Thiadiazole, 4-(4-bromophenyl)-
| Molecular Formula | C8H5BrN2S |
|---|---|
| Molecular Weight | 239.94 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.93568 |
| Heavy Atoms | 12 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 5347-18-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CSN=N2)Br |
| InChIKey | HGWOTVRPRHVJQK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(4-Bromophenyl)-1,2,3-thiadiazole (CAS 5347-18-2), with molecular formula C8H5BrN2S and molecular weight 239.94 g/mol. IUPAC: 4-(4-bromophenyl)thiadiazole.
Chemical Property Profile of 4-(4-Bromophenyl)-1,2,3-thiadiazole
Property Insights of 4-(4-Bromophenyl)-1,2,3-thiadiazole
The XLogP value of 3.1 indicates that 4-(4-Bromophenyl)-1,2,3-thiadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, 4-(4-Bromophenyl)-1,2,3-thiadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Bromophenyl)-1,2,3-thiadiazole has 0 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 4-(4-Bromophenyl)-1,2,3-thiadiazole?
The CAS number of 4-(4-Bromophenyl)-1,2,3-thiadiazole is 5347-18-2.
What is the molecular formula of 4-(4-Bromophenyl)-1,2,3-thiadiazole?
The molecular formula of 4-(4-Bromophenyl)-1,2,3-thiadiazole is C8H5BrN2S.
What is the molecular weight of 4-(4-Bromophenyl)-1,2,3-thiadiazole?
The molecular weight of 4-(4-Bromophenyl)-1,2,3-thiadiazole is 239.94 g/mol.
Where can I buy 4-(4-Bromophenyl)-1,2,3-thiadiazole?
You can request a quote for 4-(4-Bromophenyl)-1,2,3-thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Bromophenyl)-1,2,3-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Bromophenyl)-1,2,3-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.