![8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one structure](/static/products/6642/66424-59-7.webp)
8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one
TL;DR: 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one (CAS 66424-59-7) is a chemical compound with molecular formula C12H13ClN2O4S and molecular weight 316.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one
Also Known As: 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one, 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1, 8-Chloro-2,2,3a-trimethyl-3aH-5lambda~6~-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazine-1,5,5(2H,4H)-trione
| Molecular Formula | C12H13ClN2O4S |
|---|---|
| Molecular Weight | 316.03 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 84.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 316.02844 |
| Heavy Atoms | 20 |
| Complexity | 558.0 |
Chemical Identifiers
| CAS Number | 66424-59-7 |
|---|---|
| SMILES | CC1(C(=O)N2C3=C(C=CC(=C3)Cl)S(=O)(=O)NC2(O1)C)C |
| InChIKey | CZROVXUYVOFJQM-UHFFFAOYSA-N |
Product Overview
8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one (CAS 66424-59-7), with molecular formula C12H13ClN2O4S and molecular weight 316.03 g/mol. IUPAC: 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one.
Chemical Property Profile of 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one
Property Insights of 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one. The TPSA of 84.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one. Following Lipinski's Rule of Five, 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one has 1 hydrogen bond donor(s) and 5 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 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one?
The CAS number of 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one is 66424-59-7.
What is the molecular formula of 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one?
The molecular formula of 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one is C12H13ClN2O4S.
What is the molecular weight of 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one?
The molecular weight of 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one is 316.03 g/mol.
Where can I buy 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one?
You can request a quote for 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one?
Yes, KEHONG BIO provides custom synthesis services for 8-chloro-2,2,3a-trimethyl-5,5-dioxo-4H-[1,3]oxazolo[2,3-c][1,2,4]benzothiadiazin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.