![Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate structure](/static/products/4391/439131-19-8.webp)
Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate
TL;DR: Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate (CAS 439131-19-8) is a chemical compound with molecular formula C17H25ClN2O4 and molecular weight 356.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]piperazine-1-carboxylate
Also Known As: AF-399/15128694, ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate, ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]piperazine-1-carboxylate, ethyl 4-(3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl)piperazine-1-carboxylate
| Molecular Formula | C17H25ClN2O4 |
|---|---|
| Molecular Weight | 356.15 g/mol |
| LogP | 2.16222 |
| Topological Polar Surface Area | 62.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.1503 |
| Heavy Atoms | 24 |
| Complexity | 547.39215 |
Chemical Identifiers
| CAS Number | 439131-19-8 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)CC(COC2=CC(=C(C=C2)Cl)C)O |
Product Overview
Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate (CAS 439131-19-8), with molecular formula C17H25ClN2O4 and molecular weight 356.15 g/mol. IUPAC: ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]piperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate
Property Insights of Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate
The XLogP value of 2.16222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate. The TPSA of 62.24 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate. Following Lipinski's Rule of Five, Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate 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 Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate?
The CAS number of Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate is 439131-19-8.
What is the molecular formula of Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate?
The molecular formula of Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate is C17H25ClN2O4.
What is the molecular weight of Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate?
The molecular weight of Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate is 356.15 g/mol.
Where can I buy Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate?
You can request a quote for Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.