Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)-
TL;DR: Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)- (CAS 69504-55-8) is a chemical compound with molecular formula C9H6Cl2N2OS and molecular weight 259.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(6-chloro-1,2-benzothiazol-3-yl)acetamide
Also Known As: Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)-, 2-chloro-N-(6-chloro-1,2-benzothiazol-3-yl)acetamide, 2-Chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)acetamide, Acetamide,2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)-
| Molecular Formula | C9H6Cl2N2OS |
|---|---|
| Molecular Weight | 259.96 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.9578 |
| Heavy Atoms | 15 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 69504-55-8 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)SN=C2NC(=O)CCl |
| InChIKey | JFHZXKZITNCPTM-UHFFFAOYSA-N |
Product Overview
Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)- (CAS 69504-55-8), with molecular formula C9H6Cl2N2OS and molecular weight 259.96 g/mol. IUPAC: 2-chloro-N-(6-chloro-1,2-benzothiazol-3-yl)acetamide.
Chemical Property Profile of Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)-
Property Insights of Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)-
The XLogP value of 3.1 indicates that Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)-. Following Lipinski's Rule of Five, Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)- 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 Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)-?
The CAS number of Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)- is 69504-55-8.
What is the molecular formula of Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)-?
The molecular formula of Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)- is C9H6Cl2N2OS.
What is the molecular weight of Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)-?
The molecular weight of Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)- is 259.96 g/mol.
Where can I buy Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)-?
You can request a quote for Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Acetamide, 2-chloro-N-(6-chloro-1,2-benzisothiazol-3-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.