Cyclothiazide
TL;DR: Cyclothiazide (CAS 2259-96-3) is a chemical compound with molecular formula C14H16ClN3O4S2 and molecular weight 389.02707 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-bicyclo[2.2.1]hept-5-enyl)-6-chloro-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide
Also Known As: cyclothiazide, Anhydron, Aquirel, Fluidil, Renazide
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H16ClN3O4S2 |
| Molecular Weight | 389.02707 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 389.02707 Da |
| Heavy Atoms | 24 |
| Complexity | 758.0 |
| Melting Point | 229-230 |
| Solubility | FREELY SOL IN ACETONE, ETHYL ACETATE, METHANOL; SPARINGLY SOL IN ALC; PRACTICALLY INSOL IN WATER; PRACTICALLY INSOL IN CHLOROFORM, ETHER |
| SMILES | C1C2CC(C1C=C2)C3NC4=CC(=C(C=C4S(=O)(=O)N3)S(=O)(=O)N)Cl |
| InChIKey | BOCUKUHCLICSIY-UHFFFAOYSA-N |
Product Description
Applications: Cyclothiazide is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Cyclothiazide is a pharmaceutical intermediate identified by CAS number 2259-96-3 and the molecular formula C14H16ClN3O4S2 and a molecular weight of 389.03 g/mol. Physically, the compound has a solubility: FREELY SOL IN ACETONE, ETHYL ACETATE, METHANOL; SPARINGLY SOL IN ALC; PRACTICALLY INSOL IN WATER; PRACTICALLY INSOL IN CHLOROFORM, ETHER. Synonyms include cyclothiazide and Anhydron.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Cyclothiazide
Property Insights of Cyclothiazide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclothiazide. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclothiazide. Following Lipinski's Rule of Five, Cyclothiazide has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Cyclothiazide?
The CAS number of Cyclothiazide is 2259-96-3.
What is the molecular formula of Cyclothiazide?
The molecular formula of Cyclothiazide is C14H16ClN3O4S2.
What is the molecular weight of Cyclothiazide?
The molecular weight of Cyclothiazide is 389.02707 g/mol.
What are the applications of Cyclothiazide?
Cyclothiazide is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Cyclothiazide?
You can request a quote for Cyclothiazide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cyclothiazide?
Yes, CoreyChem provides custom synthesis services for Cyclothiazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.