5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine
TL;DR: 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine (CAS 35877-04-4) is a chemical compound with molecular formula C8H6ClN3S and molecular weight 211.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)-1,3,4-thiadiazol-2-amine
Also Known As: 5-(4-chlorophenyl)-1,3,4-thiadiazol-2-amine, 2-Amino-5-(4-chlorophenyl)-1,3,4-thiadiazole, 5-(4-Chloro-phenyl)-[1,3,4]thiadiazol-2-ylamine, 1,3,4-Thiadiazol-2-amine, 5-(4-chlorophenyl)-, BAS 00600009
| Molecular Formula | C8H6ClN3S |
|---|---|
| Molecular Weight | 211.00 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 80.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.9971 |
| Heavy Atoms | 13 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 35877-04-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NN=C(S2)N)Cl |
| InChIKey | OAVULPOOAHQYDZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine (CAS 35877-04-4), with molecular formula C8H6ClN3S and molecular weight 211.00 g/mol. IUPAC: 5-(4-chlorophenyl)-1,3,4-thiadiazol-2-amine.
Chemical Property Profile of 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine
Property Insights of 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine. The TPSA of 80.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine. Following Lipinski's Rule of Five, 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine has 1 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-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine?
The CAS number of 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine is 35877-04-4.
What is the molecular formula of 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine?
The molecular formula of 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine is C8H6ClN3S.
What is the molecular weight of 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine?
The molecular weight of 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine is 211.00 g/mol.
Where can I buy 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine?
You can request a quote for 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.