RefChem:1094546
TL;DR: RefChem:1094546 (CAS 37151-44-3) is a chemical compound with molecular formula C26H36Cl2N2O4 and molecular weight 510.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-5-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)pent-1-en-3-one;dihydrochloride
Also Known As: Piperazine, 1-(m-methylbenzyl)-4-(2-(3,4,5-trimethoxycinnamoyl)ethyl)-, dihydrochloride, Penten-3-one, 5-(4-(m-methylbenzyl)piperazinyl)-1-(3,4,5-trimethoxyphenyl)-, dihydrochloride, (E)-5-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)pent-1-en-3-one dihydrochloride, 1-Penten-3-one, 5-[4-[(3-methylphenyl)methyl]-1-piperazinyl]-1-(3,4,5-trimethoxyphenyl)-, dihydrochloride, RefChem:1094546
| Molecular Formula | C26H36Cl2N2O4 |
|---|---|
| Molecular Weight | 510.21 g/mol |
| LogP | 4.65462 |
| Topological Polar Surface Area | 51.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 510.2052 |
| Heavy Atoms | 34 |
| Complexity | 919.143 |
Chemical Identifiers
| CAS Number | 37151-44-3 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CN2CCN(CC2)CCC(=O)/C=C/C3=CC(=C(C(=C3)OC)OC)OC.Cl.Cl |
Product Overview
RefChem:1094546 (CAS 37151-44-3), with molecular formula C26H36Cl2N2O4 and molecular weight 510.21 g/mol. IUPAC: (E)-5-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)pent-1-en-3-one;dihydrochloride.
Chemical Property Profile of RefChem:1094546
Property Insights of RefChem:1094546
The XLogP value of 4.65462 indicates that RefChem:1094546 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.24 Ų, RefChem:1094546 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1094546 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1094546?
The CAS number of RefChem:1094546 is 37151-44-3.
What is the molecular formula of RefChem:1094546?
The molecular formula of RefChem:1094546 is C26H36Cl2N2O4.
What is the molecular weight of RefChem:1094546?
The molecular weight of RefChem:1094546 is 510.21 g/mol.
Where can I buy RefChem:1094546?
You can request a quote for RefChem:1094546 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1094546?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1094546 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.