RefChem:1094557
TL;DR: RefChem:1094557 (CAS 64011-41-2) is a chemical compound with molecular formula C24H33ClN2O5 and molecular weight 464.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-5-(4-phenylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)pent-1-en-3-one;hydrate;hydrochloride
Also Known As: Piperazine, 1-phenyl-4-(2-(3,4,5-trimethoxycinnamoyl)ethyl)-, hydrochloride, hydrate, Penten-3-one, 5-(4-phenylpiperazinyl)-1-(3,4,5-trimethoxyphenyl)-, hydrochloride, hydrate, (E)-5-(4-phenylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)pent-1-en-3-one hydrate hydrochloride, 1-Penten-3-one, 5-(4-phenyl-1-piperazinyl)-1-(3,4,5-trimethoxyphenyl)-, monohydrochloride, monohydrate, RefChem:1094557
| Molecular Formula | C24H33ClN2O5 |
|---|---|
| Molecular Weight | 464.21 g/mol |
| LogP | 3.1041 |
| Topological Polar Surface Area | 82.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 464.2078 |
| Heavy Atoms | 32 |
| Complexity | 842.94336 |
Chemical Identifiers
| CAS Number | 64011-41-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)CCN2CCN(CC2)C3=CC=CC=C3.O.Cl |
Product Overview
RefChem:1094557 (CAS 64011-41-2), with molecular formula C24H33ClN2O5 and molecular weight 464.21 g/mol. IUPAC: (E)-5-(4-phenylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)pent-1-en-3-one;hydrate;hydrochloride.
Chemical Property Profile of RefChem:1094557
Property Insights of RefChem:1094557
The XLogP value of 3.1041 indicates that RefChem:1094557 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.74 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1094557. Following Lipinski's Rule of Five, RefChem:1094557 has 0 hydrogen bond donor(s) and 6 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 RefChem:1094557?
The CAS number of RefChem:1094557 is 64011-41-2.
What is the molecular formula of RefChem:1094557?
The molecular formula of RefChem:1094557 is C24H33ClN2O5.
What is the molecular weight of RefChem:1094557?
The molecular weight of RefChem:1094557 is 464.21 g/mol.
Where can I buy RefChem:1094557?
You can request a quote for RefChem:1094557 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1094557?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1094557 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.