RefChem:1096303
TL;DR: RefChem:1096303 (CAS 34624-20-9) is a chemical compound with molecular formula C27H35Cl2N and molecular weight 443.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(Z)-3-chloro-4-(4-methylphenyl)but-2-enyl]-1-[(E)-4-(4-methylphenyl)but-2-enyl]piperidin-1-ium chloride
Also Known As: 1-(3-Chloro-4-(p-tolyl)-2-butenyl)-1-(4-(p-tolyl)-2-butenyl)piperidinium chloride, Piperidinium, 1-(3-chloro-4-(p-tolyl)-2-butenyl)-1-(4-(p-tolyl)-2-butenyl)-, chloride, 1-[(Z)-3-chloro-4-(4-methylphenyl)but-2-enyl]-1-[(E)-4-(4-methylphenyl)but-2-enyl]piperidin-1-ium chloride, RefChem:1096303
| Molecular Formula | C27H35Cl2N |
|---|---|
| Molecular Weight | 443.21 g/mol |
| LogP | 3.77224 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 8 |
| Exact Mass | 443.21466 |
| Heavy Atoms | 30 |
| Complexity | 812.9465 |
Chemical Identifiers
| CAS Number | 34624-20-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C/C=C/C[N+]2(CCCCC2)C/C=C(/CC3=CC=C(C=C3)C)\Cl.[Cl-] |
Product Overview
RefChem:1096303 (CAS 34624-20-9), with molecular formula C27H35Cl2N and molecular weight 443.21 g/mol. IUPAC: 1-[(Z)-3-chloro-4-(4-methylphenyl)but-2-enyl]-1-[(E)-4-(4-methylphenyl)but-2-enyl]piperidin-1-ium chloride.
Chemical Property Profile of RefChem:1096303
Property Insights of RefChem:1096303
The XLogP value of 3.77224 indicates that RefChem:1096303 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, RefChem:1096303 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1096303 has 0 hydrogen bond donor(s) and 0 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:1096303?
The CAS number of RefChem:1096303 is 34624-20-9.
What is the molecular formula of RefChem:1096303?
The molecular formula of RefChem:1096303 is C27H35Cl2N.
What is the molecular weight of RefChem:1096303?
The molecular weight of RefChem:1096303 is 443.21 g/mol.
Where can I buy RefChem:1096303?
You can request a quote for RefChem:1096303 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1096303?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1096303 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.