N-(2,1,3-benzothiadiazol-4-yl)acetamide
TL;DR: N-(2,1,3-benzothiadiazol-4-yl)acetamide (CAS 16540-61-7) is a chemical compound with molecular formula C8H7N3OS and molecular weight 193.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,1,3-benzothiadiazol-4-yl)acetamide
Also Known As: N-(2,1,3-benzothiadiazol-4-yl)acetamide, 4-acetamidobenzo-2,1,3-thiadiazole, N-benzo[c]1,2,5-thiadiazol-4-ylacetamide, Acetamide, N-2,1,3-benzothiadiazol-4-yl-, N-(benzo[c][1,2,5]thiadiazol-4-yl)acetamide
| Molecular Formula | C8H7N3OS |
|---|---|
| Molecular Weight | 193.03 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.03099 |
| Heavy Atoms | 13 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 16540-61-7 |
|---|---|
| SMILES | CC(=O)NC1=CC=CC2=NSN=C21 |
| InChIKey | HVBDCQSQTXJVJS-UHFFFAOYSA-N |
Product Overview
N-(2,1,3-benzothiadiazol-4-yl)acetamide (CAS 16540-61-7), with molecular formula C8H7N3OS and molecular weight 193.03 g/mol. IUPAC: N-(2,1,3-benzothiadiazol-4-yl)acetamide.
Chemical Property Profile of N-(2,1,3-benzothiadiazol-4-yl)acetamide
Property Insights of N-(2,1,3-benzothiadiazol-4-yl)acetamide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,1,3-benzothiadiazol-4-yl)acetamide. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,1,3-benzothiadiazol-4-yl)acetamide. Following Lipinski's Rule of Five, N-(2,1,3-benzothiadiazol-4-yl)acetamide has 1 hydrogen bond donor(s) and 4 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 N-(2,1,3-benzothiadiazol-4-yl)acetamide?
The CAS number of N-(2,1,3-benzothiadiazol-4-yl)acetamide is 16540-61-7.
What is the molecular formula of N-(2,1,3-benzothiadiazol-4-yl)acetamide?
The molecular formula of N-(2,1,3-benzothiadiazol-4-yl)acetamide is C8H7N3OS.
What is the molecular weight of N-(2,1,3-benzothiadiazol-4-yl)acetamide?
The molecular weight of N-(2,1,3-benzothiadiazol-4-yl)acetamide is 193.03 g/mol.
Where can I buy N-(2,1,3-benzothiadiazol-4-yl)acetamide?
You can request a quote for N-(2,1,3-benzothiadiazol-4-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,1,3-benzothiadiazol-4-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,1,3-benzothiadiazol-4-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.