4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
TL;DR: 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione (CAS 102308-74-7) is a chemical compound with molecular formula C9H10N2O3S and molecular weight 226.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethyl-1,1-dioxo-1λ6,2,4-benzothiadiazin-3-one
Also Known As: 4-Ethyl-2H-1,2,4-benzothiadiazin-3(4H)-on-1,1-dioxide, 4-ethyl-1,1-dioxo-1, 4-ethyl-1,1-dioxo-1lambda6,2,4-benzothiadiazin-3-one, 2H-1,2,4-Benzothiadiazin-3(4H)-one,4-ethyl-, 1,1-dioxide, E6,2,4-benzothiadiazin-3-one
| Molecular Formula | C9H10N2O3S |
|---|---|
| Molecular Weight | 226.04 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.04121 |
| Heavy Atoms | 15 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 102308-74-7 |
|---|---|
| SMILES | CCN1C2=CC=CC=C2S(=O)(=O)NC1=O |
| InChIKey | XOJIAIHJDLBFMP-UHFFFAOYSA-N |
Product Overview
4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione (CAS 102308-74-7), with molecular formula C9H10N2O3S and molecular weight 226.04 g/mol. IUPAC: 4-ethyl-1,1-dioxo-1λ6,2,4-benzothiadiazin-3-one.
Chemical Property Profile of 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Property Insights of 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione. Following Lipinski's Rule of Five, 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione has 1 hydrogen bond donor(s) and 3 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 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione?
The CAS number of 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione is 102308-74-7.
What is the molecular formula of 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione?
The molecular formula of 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione is C9H10N2O3S.
What is the molecular weight of 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione?
The molecular weight of 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione is 226.04 g/mol.
Where can I buy 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione?
You can request a quote for 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 4-Ethyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.