(3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one
TL;DR: (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one (CAS 67288-79-3) is a chemical compound with molecular formula C20H17Cl2NO and molecular weight 357.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z,5E)-3,5-bis[(2-chlorophenyl)methylidene]-1-methylpiperidin-4-one
Also Known As: BAS 00873923, (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one, 3,5-Bis-(2-chloro-benzylidene)-1-methyl-piperidin-4-one, (3Z,5E)-3,5-bis[(2-chlorophenyl)methylidene]-1-methylpiperidin-4-one
| Molecular Formula | C20H17Cl2NO |
|---|---|
| Molecular Weight | 357.07 g/mol |
| LogP | 4.9749 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 357.06873 |
| Heavy Atoms | 24 |
| Complexity | 771.5374 |
Chemical Identifiers
| CAS Number | 67288-79-3 |
|---|---|
| SMILES | CN1C/C(=C\C2=CC=CC=C2Cl)/C(=O)/C(=C\C3=CC=CC=C3Cl)/C1 |
Product Overview
(3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one (CAS 67288-79-3), with molecular formula C20H17Cl2NO and molecular weight 357.07 g/mol. IUPAC: (3Z,5E)-3,5-bis[(2-chlorophenyl)methylidene]-1-methylpiperidin-4-one.
Chemical Property Profile of (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one
Property Insights of (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one
The XLogP value of 4.9749 indicates that (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one has 0 hydrogen bond donor(s) and 2 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 (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one?
The CAS number of (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one is 67288-79-3.
What is the molecular formula of (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one?
The molecular formula of (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one is C20H17Cl2NO.
What is the molecular weight of (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one?
The molecular weight of (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one is 357.07 g/mol.
Where can I buy (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one?
You can request a quote for (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (3Z,5E)-3,5-bis(2-chlorobenzylidene)-1-methylpiperidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.