AO-022/41151200
TL;DR: AO-022/41151200 (CAS 488794-30-5) is a chemical compound with molecular formula C21H17ClFN3O2S and molecular weight 429.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-methylphenyl)-2-[[5-cyano-4-(2-fluorophenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide
Also Known As: AO-022/41151200, N-(3-chloro-4-methylphenyl)-2-[[5-cyano-4-(2-fluorophenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide, N-(3-chloro-4-methylphenyl)-2-{[3-cyano-4-(2-fluorophenyl)-6-hydroxy-4,5-dihydropyridin-2-yl]sulfanyl}acetamide, N-(3-chloro-4-methylphenyl)-2-((3-cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl)thio)acetamide, N-(3-chloro-4-methylphenyl)-2-{[3-cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydro-2-pyridinyl]sulfanyl}acetamide
| Molecular Formula | C21H17ClFN3O2S |
|---|---|
| Molecular Weight | 429.07 g/mol |
| LogP | 4.4981 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 429.0714 |
| Heavy Atoms | 29 |
| Complexity | 1048.462 |
Chemical Identifiers
| CAS Number | 488794-30-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)CSC2=C(C(CC(=O)N2)C3=CC=CC=C3F)C#N)Cl |
Product Overview
AO-022/41151200 (CAS 488794-30-5), with molecular formula C21H17ClFN3O2S and molecular weight 429.07 g/mol. IUPAC: N-(3-chloro-4-methylphenyl)-2-[[5-cyano-4-(2-fluorophenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide.
Chemical Property Profile of AO-022/41151200
Property Insights of AO-022/41151200
The XLogP value of 4.4981 indicates that AO-022/41151200 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-022/41151200. Following Lipinski's Rule of Five, AO-022/41151200 has 2 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 AO-022/41151200?
The CAS number of AO-022/41151200 is 488794-30-5.
What is the molecular formula of AO-022/41151200?
The molecular formula of AO-022/41151200 is C21H17ClFN3O2S.
What is the molecular weight of AO-022/41151200?
The molecular weight of AO-022/41151200 is 429.07 g/mol.
Where can I buy AO-022/41151200?
You can request a quote for AO-022/41151200 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/41151200?
Yes, KEHONG BIO provides custom synthesis services for AO-022/41151200 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.