4-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
TL;DR: 4-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione (CAS 964-08-9) is a chemical compound with molecular formula C14H12N2O3S and molecular weight 288.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzyl-1,1-dioxo-1λ6,2,4-benzothiadiazin-3-one
Also Known As: 4-benzyl-1,1-dioxo-1, 4-Benzyl-2H-1,2,4-benzothiadiazin-3(4H)-on-1,1-dioxide, 4-benzyl-1,1-dioxo-1lambda6,2,4-benzothiadiazin-3-one, 4-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione, 4-Benzyl-2H-1,2,4-benzothiadiazin-3 -on-1,1-dioxide
| Molecular Formula | C14H12N2O3S |
|---|---|
| Molecular Weight | 288.06 g/mol |
| LogP | 2.1051 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.05685 |
| Heavy Atoms | 20 |
| Complexity | 756.9983 |
Chemical Identifiers
| CAS Number | 964-08-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C3=CC=CC=C3S(=O)(=O)NC2=O |
Product Overview
4-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione (CAS 964-08-9), with molecular formula C14H12N2O3S and molecular weight 288.06 g/mol. IUPAC: 4-benzyl-1,1-dioxo-1λ6,2,4-benzothiadiazin-3-one.
Chemical Property Profile of 4-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Property Insights of 4-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
The XLogP value of 2.1051 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione. Following Lipinski's Rule of Five, 4-Benzyl-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-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione?
The CAS number of 4-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione is 964-08-9.
What is the molecular formula of 4-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione?
The molecular formula of 4-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione is C14H12N2O3S.
What is the molecular weight of 4-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione?
The molecular weight of 4-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione is 288.06 g/mol.
Where can I buy 4-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione?
You can request a quote for 4-Benzyl-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-Benzyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzyl-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.