AO-022/43453156
TL;DR: AO-022/43453156 (CAS 896074-88-7) is a chemical compound with molecular formula C20H15F2N3OS and molecular weight 383.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(2-fluorophenyl)-3-(4-fluorophenyl)-6-oxo-2,4,7,8-tetrahydropyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Also Known As: AO-022/43453156, 8-(2-fluorophenyl)-3-(4-fluorophenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 8-(2-fluorophenyl)-3-(4-fluorophenyl)-6-oxo-2,4,7,8-tetrahydropyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 8-(2-fluorophenyl)-3-(4-fluorophenyl)-6-oxo-2,3,4,6,7,8-hexahydropyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 8-(2-FLUOROPHENYL)-3-(4-FLUOROPHENYL)-6-OXO-2H,3H,4H,6H,7H,8H-PYRIDO[2,1-B][1,3,5]THIADIAZINE-9-CARBONITRILE
| Molecular Formula | C20H15F2N3OS |
|---|---|
| Molecular Weight | 383.09 g/mol |
| LogP | 4.18428 |
| Topological Polar Surface Area | 47.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 383.0904 |
| Heavy Atoms | 27 |
| Complexity | 967.93726 |
Chemical Identifiers
| CAS Number | 896074-88-7 |
|---|---|
| SMILES | C1C(C(=C2N(C1=O)CN(CS2)C3=CC=C(C=C3)F)C#N)C4=CC=CC=C4F |
Product Overview
AO-022/43453156 (CAS 896074-88-7), with molecular formula C20H15F2N3OS and molecular weight 383.09 g/mol. IUPAC: 8-(2-fluorophenyl)-3-(4-fluorophenyl)-6-oxo-2,4,7,8-tetrahydropyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile.
Chemical Property Profile of AO-022/43453156
Property Insights of AO-022/43453156
The XLogP value of 4.18428 indicates that AO-022/43453156 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.34 Ų, AO-022/43453156 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-022/43453156 has 0 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-022/43453156?
The CAS number of AO-022/43453156 is 896074-88-7.
What is the molecular formula of AO-022/43453156?
The molecular formula of AO-022/43453156 is C20H15F2N3OS.
What is the molecular weight of AO-022/43453156?
The molecular weight of AO-022/43453156 is 383.09 g/mol.
Where can I buy AO-022/43453156?
You can request a quote for AO-022/43453156 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43453156?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43453156 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.