AF-399/41899112
TL;DR: AF-399/41899112 (CAS 609793-71-7) is a chemical compound with molecular formula C17H16Cl2N2O3S and molecular weight 398.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-(2,4-dichlorophenyl)-8-methyl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Also Known As: AF-399/41899112, ethyl 6-(2,4-dichlorophenyl)-8-methyl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate, F1423-0059, ethyl 6-(2,4-dichlorophenyl)-8-methyl-4-oxo-2H,3H,4H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate, ethyl 6-(2,4-dichlorophenyl)-8-methyl-4-oxo-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate
| Molecular Formula | C17H16Cl2N2O3S |
|---|---|
| Molecular Weight | 398.03 g/mol |
| LogP | 4.2067 |
| Topological Polar Surface Area | 58.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 398.02588 |
| Heavy Atoms | 25 |
| Complexity | 807.08276 |
Chemical Identifiers
| CAS Number | 609793-71-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=C(C=C(C=C3)Cl)Cl)C(=O)CCS2)C |
Product Overview
AF-399/41899112 (CAS 609793-71-7), with molecular formula C17H16Cl2N2O3S and molecular weight 398.03 g/mol. IUPAC: ethyl 6-(2,4-dichlorophenyl)-8-methyl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate.
Chemical Property Profile of AF-399/41899112
Property Insights of AF-399/41899112
The XLogP value of 4.2067 indicates that AF-399/41899112 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.97 Ų, AF-399/41899112 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/41899112 has 0 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 AF-399/41899112?
The CAS number of AF-399/41899112 is 609793-71-7.
What is the molecular formula of AF-399/41899112?
The molecular formula of AF-399/41899112 is C17H16Cl2N2O3S.
What is the molecular weight of AF-399/41899112?
The molecular weight of AF-399/41899112 is 398.03 g/mol.
Where can I buy AF-399/41899112?
You can request a quote for AF-399/41899112 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41899112?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41899112 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.