3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine
TL;DR: 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine (CAS 7523-57-1) is a chemical compound with molecular formula C3H2Cl3N3S and molecular weight 216.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(trichloromethyl)-1,2,4-thiadiazol-5-amine
Also Known As: 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine, TRIMETHYLSULFONIUMMETHYLSULFATE, 3-(TRICHLOROMETHYL)1,2,4-THIADIAZOL-5-AMINE, 5-amino-3trichloromethyl-1,2,4-thiadiazole, 3-trichloromethyl-5-amino-1,2,4-thiadiazole
| Molecular Formula | C3H2Cl3N3S |
|---|---|
| Molecular Weight | 216.90 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 80.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 216.9035 |
| Heavy Atoms | 10 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 7523-57-1 |
|---|---|
| SMILES | C1(=NSC(=N1)N)C(Cl)(Cl)Cl |
| InChIKey | QYNMMVVOSGGXPZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine (CAS 7523-57-1), with molecular formula C3H2Cl3N3S and molecular weight 216.90 g/mol. IUPAC: 3-(trichloromethyl)-1,2,4-thiadiazol-5-amine.
Chemical Property Profile of 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine
Property Insights of 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine. The TPSA of 80.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine. Following Lipinski's Rule of Five, 3-(Trichloromethyl)-1,2,4-thiadiazol-5-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 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine?
The CAS number of 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine is 7523-57-1.
What is the molecular formula of 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine?
The molecular formula of 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine is C3H2Cl3N3S.
What is the molecular weight of 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine?
The molecular weight of 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine is 216.90 g/mol.
Where can I buy 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine?
You can request a quote for 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-(Trichloromethyl)-1,2,4-thiadiazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.