AO-022/41827517
TL;DR: AO-022/41827517 (CAS 797768-24-2) is a chemical compound with molecular formula C25H22FN3O2S and molecular weight 447.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-4-(2-fluorophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]-N-(2-methylphenyl)acetamide
Also Known As: AO-022/41827517, 2-((3-cyano-4-(2-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl)thio)-N-(o-tolyl)acetamide, 2-[[3-cyano-4-(2-fluorophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]-N-(2-methylphenyl)acetamide, 2-{[3-cyano-4-(2-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydro-2-quinolinyl]sulfanyl}-N-(2-methylphenyl)acetamide, 2-{[3-cyano-4-(2-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide
| Molecular Formula | C25H22FN3O2S |
|---|---|
| Molecular Weight | 447.14 g/mol |
| LogP | 4.9351 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 447.14166 |
| Heavy Atoms | 32 |
| Complexity | 1195.6683 |
Chemical Identifiers
| CAS Number | 797768-24-2 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=CC=CC=C4F)C#N |
Product Overview
AO-022/41827517 (CAS 797768-24-2), with molecular formula C25H22FN3O2S and molecular weight 447.14 g/mol. IUPAC: 2-[[3-cyano-4-(2-fluorophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]-N-(2-methylphenyl)acetamide.
Chemical Property Profile of AO-022/41827517
Property Insights of AO-022/41827517
The XLogP value of 4.9351 indicates that AO-022/41827517 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.99 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/41827517. Following Lipinski's Rule of Five, AO-022/41827517 has 2 hydrogen bond donor(s) and 5 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 AO-022/41827517?
The CAS number of AO-022/41827517 is 797768-24-2.
What is the molecular formula of AO-022/41827517?
The molecular formula of AO-022/41827517 is C25H22FN3O2S.
What is the molecular weight of AO-022/41827517?
The molecular weight of AO-022/41827517 is 447.14 g/mol.
Where can I buy AO-022/41827517?
You can request a quote for AO-022/41827517 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/41827517?
Yes, KEHONG BIO provides custom synthesis services for AO-022/41827517 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.