N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide
TL;DR: N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide (CAS 842956-21-2) is a chemical compound with molecular formula C8H6ClN3OS and molecular weight 226.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,1,3-benzothiadiazol-5-yl)-2-chloroacetamide
Also Known As: N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide, N-(2,1,3-benzothiadiazol-5-yl)-2-chloroacetamide, BAS 01357238, N-Benzo[1,2,5]thiadiazol-5-yl-2-chloro-acetamide, N-(benzo[c][1,2,5]thiadiazol-5-yl)-2-chloroacetamide
| Molecular Formula | C8H6ClN3OS |
|---|---|
| Molecular Weight | 226.99 g/mol |
| LogP | 1.8686 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.992 |
| Heavy Atoms | 14 |
| Complexity | 470.30927 |
Chemical Identifiers
| CAS Number | 842956-21-2 |
|---|---|
| SMILES | C1=CC2=NSN=C2C=C1NC(=O)CCl |
Product Overview
N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide (CAS 842956-21-2), with molecular formula C8H6ClN3OS and molecular weight 226.99 g/mol. IUPAC: N-(2,1,3-benzothiadiazol-5-yl)-2-chloroacetamide.
Chemical Property Profile of N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide
Property Insights of N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide
The XLogP value of 1.8686 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide. With a topological polar surface area (TPSA) of 54.88 Ų, N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide 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-5-yl-2-chloroacetamide?
The CAS number of N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide is 842956-21-2.
What is the molecular formula of N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide?
The molecular formula of N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide is C8H6ClN3OS.
What is the molecular weight of N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide?
The molecular weight of N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide is 226.99 g/mol.
Where can I buy N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide?
You can request a quote for N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide 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-5-yl-2-chloroacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-2,1,3-benzothiadiazol-5-yl-2-chloroacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.