C20H27N3O2.ClH.1/4H2O
TL;DR: C20H27N3O2.ClH.1/4H2O (CAS 77246-53-8) is a chemical compound with molecular formula C20H28ClN3O2 and molecular weight 377.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-ethoxy-2-pyridin-2-ylethyl)-4-(2-methoxyphenyl)piperazine;hydrochloride
Also Known As: C20H27N3O2.ClH.1/4H2O, C20-H27-N3-O2.Cl-H.1/4H2-O, Piperazine, 1-(2-ethoxy-2-(2-pyridyl)ethyl)-4-(o-methoxyphenyl)-, hydrochloride, hydrate (4:4:1), 1-(2-ethoxy-2-pyridin-2-ylethyl)-4-(2-methoxyphenyl)piperazine hydrochloride, 1-[2-Ethoxy-2-(pyridin-2-yl)ethyl]-4-(2-methoxyphenyl)piperazine--hydrogen chloride (1/1)
| Molecular Formula | C20H28ClN3O2 |
|---|---|
| Molecular Weight | 377.19 g/mol |
| LogP | 3.4118 |
| Topological Polar Surface Area | 37.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 377.187 |
| Heavy Atoms | 26 |
| Complexity | 648.51434 |
Chemical Identifiers
| CAS Number | 77246-53-8 |
|---|---|
| SMILES | CCOC(CN1CCN(CC1)C2=CC=CC=C2OC)C3=CC=CC=N3.Cl |
Product Overview
C20H27N3O2.ClH.1/4H2O (CAS 77246-53-8), with molecular formula C20H28ClN3O2 and molecular weight 377.19 g/mol. IUPAC: 1-(2-ethoxy-2-pyridin-2-ylethyl)-4-(2-methoxyphenyl)piperazine;hydrochloride.
Chemical Property Profile of C20H27N3O2.ClH.1/4H2O
Property Insights of C20H27N3O2.ClH.1/4H2O
The XLogP value of 3.4118 indicates that C20H27N3O2.ClH.1/4H2O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.83 Ų, C20H27N3O2.ClH.1/4H2O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C20H27N3O2.ClH.1/4H2O 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 C20H27N3O2.ClH.1/4H2O?
The CAS number of C20H27N3O2.ClH.1/4H2O is 77246-53-8.
What is the molecular formula of C20H27N3O2.ClH.1/4H2O?
The molecular formula of C20H27N3O2.ClH.1/4H2O is C20H28ClN3O2.
What is the molecular weight of C20H27N3O2.ClH.1/4H2O?
The molecular weight of C20H27N3O2.ClH.1/4H2O is 377.19 g/mol.
Where can I buy C20H27N3O2.ClH.1/4H2O?
You can request a quote for C20H27N3O2.ClH.1/4H2O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C20H27N3O2.ClH.1/4H2O?
Yes, KEHONG BIO provides custom synthesis services for C20H27N3O2.ClH.1/4H2O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.