1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide
TL;DR: 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide (CAS 21784-55-4) is a chemical compound with molecular formula C10H11NO3S and molecular weight 225.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-2,2-dioxo-1H-2λ6,3-benzothiazin-4-one
Also Known As: 3-ethyl-2,2-dioxo-1H-2, 3-Ethyl-1H-2,3-benzothiazin-4(3H)-one 2,2-dioxide, 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide, E6,3-benzothiazin-4-one, 1H-2,3-Benzothiazin-4(3H)-one,3-ethyl-, 2,2-dioxide
| Molecular Formula | C10H11NO3S |
|---|---|
| Molecular Weight | 225.05 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 225.04596 |
| Heavy Atoms | 15 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 21784-55-4 |
|---|---|
| SMILES | CCN1C(=O)C2=CC=CC=C2CS1(=O)=O |
| InChIKey | FEPNBMKNKFJTBE-UHFFFAOYSA-N |
Product Overview
1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide (CAS 21784-55-4), with molecular formula C10H11NO3S and molecular weight 225.05 g/mol. IUPAC: 3-ethyl-2,2-dioxo-1H-2λ6,3-benzothiazin-4-one.
Chemical Property Profile of 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide
Property Insights of 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide. Following Lipinski's Rule of Five, 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide has 0 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 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide?
The CAS number of 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide is 21784-55-4.
What is the molecular formula of 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide?
The molecular formula of 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide is C10H11NO3S.
What is the molecular weight of 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide?
The molecular weight of 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide is 225.05 g/mol.
Where can I buy 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide?
You can request a quote for 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 1H-2,3-Benzothiazin-4(3H)-one, 3-ethyl-, 2,3-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.