2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole
TL;DR: 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole (CAS 851983-40-9) is a chemical compound with molecular formula C9H6Cl2N2S and molecular weight 243.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(chloromethyl)-5-(4-chlorophenyl)-1,3,4-thiadiazole
Also Known As: 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole, 2-(chloromethyl)-5-(4-chlorophenyl)-1,3,4-thiadiazole, 5-(chloromethyl)-2-(4-chlorophenyl)-1,3,4-thiadiazole, RefChem:379993
| Molecular Formula | C9H6Cl2N2S |
|---|---|
| Molecular Weight | 243.96 g/mol |
| LogP | 3.5973 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.96288 |
| Heavy Atoms | 14 |
| Complexity | 424.63193 |
Chemical Identifiers
| CAS Number | 851983-40-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NN=C(S2)CCl)Cl |
Product Overview
2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole (CAS 851983-40-9), with molecular formula C9H6Cl2N2S and molecular weight 243.96 g/mol. IUPAC: 2-(chloromethyl)-5-(4-chlorophenyl)-1,3,4-thiadiazole.
Chemical Property Profile of 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole
Property Insights of 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole
The XLogP value of 3.5973 indicates that 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-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 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole?
The CAS number of 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole is 851983-40-9.
What is the molecular formula of 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole?
The molecular formula of 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole is C9H6Cl2N2S.
What is the molecular weight of 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole?
The molecular weight of 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole is 243.96 g/mol.
Where can I buy 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole?
You can request a quote for 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloromethyl-5-(4-chlorophenyl)-1,3,4-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.