AF-399/15128670
TL;DR: AF-399/15128670 (CAS 439130-76-4) is a chemical compound with molecular formula C20H32N2O4 and molecular weight 364.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-hydroxy-3-(3-methyl-4-propan-2-ylphenoxy)propyl]piperazine-1-carboxylate
Also Known As: AF-399/15128670, Ethyl 4-[2-hydroxy-3-(3-methyl-4-propan-2-yl-phenoxy)propyl]piperazine-1-carboxylate, ethyl 4-[2-hydroxy-3-(3-methyl-4-propan-2-ylphenoxy)propyl]piperazine-1-carboxylate, ethyl 4-[2-hydroxy-3-(4-isopropyl-3-methylphenoxy)propyl]-1-piperazinecarboxylate, 1-Piperazinecarboxylic acid, 4-[2-hydroxy-3-[3-methyl-4-(1-methylethyl)phenoxy]propyl]-, ethyl ester
| Molecular Formula | C20H32N2O4 |
|---|---|
| Molecular Weight | 364.24 g/mol |
| LogP | 2.63222 |
| Topological Polar Surface Area | 62.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 364.2362 |
| Heavy Atoms | 26 |
| Complexity | 583.17395 |
Chemical Identifiers
| CAS Number | 439130-76-4 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)CC(COC2=CC(=C(C=C2)C(C)C)C)O |
Product Overview
AF-399/15128670 (CAS 439130-76-4), with molecular formula C20H32N2O4 and molecular weight 364.24 g/mol. IUPAC: ethyl 4-[2-hydroxy-3-(3-methyl-4-propan-2-ylphenoxy)propyl]piperazine-1-carboxylate.
Chemical Property Profile of AF-399/15128670
Property Insights of AF-399/15128670
The XLogP value of 2.63222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/15128670. The TPSA of 62.24 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/15128670. Following Lipinski's Rule of Five, AF-399/15128670 has 1 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-399/15128670?
The CAS number of AF-399/15128670 is 439130-76-4.
What is the molecular formula of AF-399/15128670?
The molecular formula of AF-399/15128670 is C20H32N2O4.
What is the molecular weight of AF-399/15128670?
The molecular weight of AF-399/15128670 is 364.24 g/mol.
Where can I buy AF-399/15128670?
You can request a quote for AF-399/15128670 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15128670?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15128670 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.