3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
TL;DR: 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione (CAS 16288-76-9) is a chemical compound with molecular formula C8H9N3O2S and molecular weight 211.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-1,1-dioxo-1λ6,2,4-benzothiadiazin-3-amine
Also Known As: 4-methyl-1,1-dioxo-1, 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione, 4-methyl-1,1-dioxobenzo[e][1,2,4]thiadiazin-3-amine, 4-methyl-4H-1,2,4-benzothiadiazin-3-amine 1,1-dioxide, RefChem:276489
| Molecular Formula | C8H9N3O2S |
|---|---|
| Molecular Weight | 211.04 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 84.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 211.04155 |
| Heavy Atoms | 14 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 16288-76-9 |
|---|---|
| SMILES | CN1C2=CC=CC=C2S(=O)(=O)N=C1N |
| InChIKey | JFIQUNPFQZKHRO-UHFFFAOYSA-N |
Product Overview
3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione (CAS 16288-76-9), with molecular formula C8H9N3O2S and molecular weight 211.04 g/mol. IUPAC: 4-methyl-1,1-dioxo-1λ6,2,4-benzothiadiazin-3-amine.
Chemical Property Profile of 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Property Insights of 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione. The TPSA of 84.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione. Following Lipinski's Rule of Five, 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione 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 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione?
The CAS number of 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione is 16288-76-9.
What is the molecular formula of 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione?
The molecular formula of 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione is C8H9N3O2S.
What is the molecular weight of 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione?
The molecular weight of 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione is 211.04 g/mol.
Where can I buy 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione?
You can request a quote for 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.