AF-399/15599034
TL;DR: AF-399/15599034 (CAS 376351-90-5) is a chemical compound with molecular formula C20H19F3N2O5 and molecular weight 424.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-hydroxy-2-oxo-6-(3-phenoxyphenyl)-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate
Also Known As: AF-399/15599034, ethyl 4-hydroxy-2-oxo-6-(3-phenoxyphenyl)-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate, ethyl 4-hydroxy-2-oxo-6-(3-phenoxyphenyl)-4-(trifluoromethyl)hexahydro-5-pyrimidinecarboxylate, ethyl 4-hydroxy-2-oxo-6-(3-phenoxyphenyl)-4-(trifluoromethyl)hexahydropyrimidine-5-carboxylate
| Molecular Formula | C20H19F3N2O5 |
|---|---|
| Molecular Weight | 424.12 g/mol |
| LogP | 3.263 |
| Topological Polar Surface Area | 96.89 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.1246 |
| Heavy Atoms | 30 |
| Complexity | 922.158 |
Chemical Identifiers
| CAS Number | 376351-90-5 |
|---|---|
| SMILES | CCOC(=O)C1C(NC(=O)NC1(C(F)(F)F)O)C2=CC(=CC=C2)OC3=CC=CC=C3 |
Product Overview
AF-399/15599034 (CAS 376351-90-5), with molecular formula C20H19F3N2O5 and molecular weight 424.12 g/mol. IUPAC: ethyl 4-hydroxy-2-oxo-6-(3-phenoxyphenyl)-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate.
Chemical Property Profile of AF-399/15599034
Property Insights of AF-399/15599034
The XLogP value of 3.263 indicates that AF-399/15599034 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.89 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/15599034. Following Lipinski's Rule of Five, AF-399/15599034 has 3 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-399/15599034?
The CAS number of AF-399/15599034 is 376351-90-5.
What is the molecular formula of AF-399/15599034?
The molecular formula of AF-399/15599034 is C20H19F3N2O5.
What is the molecular weight of AF-399/15599034?
The molecular weight of AF-399/15599034 is 424.12 g/mol.
Where can I buy AF-399/15599034?
You can request a quote for AF-399/15599034 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15599034?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15599034 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.