Mebutizide
TL;DR: Mebutizide (CAS 3568-00-1) is a chemical compound with molecular formula C13H20ClN3O4S2 and molecular weight 381.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3-(3-methylpentan-2-yl)-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide
Also Known As: Mebutizide, Mebutizid, Mebuthiazide, Neoniagar, Mebutizida
| Molecular Formula | C13H20ClN3O4S2 |
|---|---|
| Molecular Weight | 381.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 381.05838 |
| Heavy Atoms | 23 |
| Complexity | 629.0 |
Chemical Identifiers
| CAS Number | 3568-00-1 |
|---|---|
| SMILES | CCC(C)C(C)C1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl |
| InChIKey | KJLLKLRVCJAFRY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Mebutizide (CAS 3568-00-1), with molecular formula C13H20ClN3O4S2 and molecular weight 381.06 g/mol. IUPAC: 6-chloro-3-(3-methylpentan-2-yl)-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide.
Chemical Property Profile of Mebutizide
Property Insights of Mebutizide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mebutizide. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mebutizide. Following Lipinski's Rule of Five, Mebutizide 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
Frequently Asked Questions
What is the CAS number of Mebutizide?
The CAS number of Mebutizide is 3568-00-1.
What is the molecular formula of Mebutizide?
The molecular formula of Mebutizide is C13H20ClN3O4S2.
What is the molecular weight of Mebutizide?
The molecular weight of Mebutizide is 381.06 g/mol.
Where can I buy Mebutizide?
You can request a quote for Mebutizide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mebutizide?
Yes, KEHONG BIO provides custom synthesis services for Mebutizide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.