AP-853/41807391
TL;DR: AP-853/41807391 (CAS 663168-68-1) is a chemical compound with molecular formula C18H16N2O4S and molecular weight 356.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-prop-1-en-2-ylphenyl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide
Also Known As: AP-853/41807391, N-(2-prop-1-en-2-ylphenyl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide, 2-(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)-N-(2-isopropenylphenyl)acetamide, 2-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(prop-1-en-2-yl)phenyl]acetamide
| Molecular Formula | C18H16N2O4S |
|---|---|
| Molecular Weight | 356.08 g/mol |
| LogP | 2.5029 |
| Topological Polar Surface Area | 83.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.08307 |
| Heavy Atoms | 25 |
| Complexity | 995.64056 |
Chemical Identifiers
| CAS Number | 663168-68-1 |
|---|---|
| SMILES | CC(=C)C1=CC=CC=C1NC(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O |
Product Overview
AP-853/41807391 (CAS 663168-68-1), with molecular formula C18H16N2O4S and molecular weight 356.08 g/mol. IUPAC: N-(2-prop-1-en-2-ylphenyl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide.
Chemical Property Profile of AP-853/41807391
Property Insights of AP-853/41807391
The XLogP value of 2.5029 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AP-853/41807391. The TPSA of 83.55 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-853/41807391. Following Lipinski's Rule of Five, AP-853/41807391 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 AP-853/41807391?
The CAS number of AP-853/41807391 is 663168-68-1.
What is the molecular formula of AP-853/41807391?
The molecular formula of AP-853/41807391 is C18H16N2O4S.
What is the molecular weight of AP-853/41807391?
The molecular weight of AP-853/41807391 is 356.08 g/mol.
Where can I buy AP-853/41807391?
You can request a quote for AP-853/41807391 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-853/41807391?
Yes, KEHONG BIO provides custom synthesis services for AP-853/41807391 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.