Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate
TL;DR: Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate (CAS 175203-25-5) is a chemical compound with molecular formula C10H11N3O4S2 and molecular weight 301.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)acetate
Also Known As: Maybridge1_005070, ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate, ethyl 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)acetate, Glycine, N-(2,1,3-benzothiadiazol-4-ylsulfonyl)-, ethyl ester, Ethyl N-(2,1,3-benzothiadiazole-4-sulfonyl)glycinate
| Molecular Formula | C10H11N3O4S2 |
|---|---|
| Molecular Weight | 301.02 g/mol |
| LogP | 0.5327 |
| Topological Polar Surface Area | 98.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.0191 |
| Heavy Atoms | 19 |
| Complexity | 695.6176 |
Chemical Identifiers
| CAS Number | 175203-25-5 |
|---|---|
| SMILES | CCOC(=O)CNS(=O)(=O)C1=CC=CC2=NSN=C21 |
Product Overview
Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate (CAS 175203-25-5), with molecular formula C10H11N3O4S2 and molecular weight 301.02 g/mol. IUPAC: ethyl 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)acetate.
Chemical Property Profile of Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate
Property Insights of Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate
The XLogP value of 0.5327 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate. The TPSA of 98.25 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate. Following Lipinski's Rule of Five, Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate has 1 hydrogen bond donor(s) and 7 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 Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate?
The CAS number of Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate is 175203-25-5.
What is the molecular formula of Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate?
The molecular formula of Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate is C10H11N3O4S2.
What is the molecular weight of Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate?
The molecular weight of Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate is 301.02 g/mol.
Where can I buy Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate?
You can request a quote for Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.