4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride
TL;DR: 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride (CAS 54237-25-1) is a chemical compound with molecular formula C20H20ClNO and molecular weight 325.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dibenzylidene-1-methylpiperidin-4-one;hydrochloride
Also Known As: 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride, 3,5-dibenzylidene-1-methyl-4-piperidone, hydrochloride, 3,5-dibenzylidene-1-methylpiperidin-4-one,hydrochloride, 1-Methyl-3,5-bis(phenylmethylene)-4-piperidinone, hydrochloride, 3,5-Dibenzylidene-1-methylpiperidin-4-one--hydrogen chloride (1/1)
| Molecular Formula | C20H20ClNO |
|---|---|
| Molecular Weight | 325.12 g/mol |
| LogP | 4.0899 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 325.12335 |
| Heavy Atoms | 23 |
| Complexity | 410.0 |
Chemical Identifiers
| CAS Number | 54237-25-1 |
|---|---|
| SMILES | CN1CC(=CC2=CC=CC=C2)C(=O)C(=CC3=CC=CC=C3)C1.Cl |
| InChIKey | BHDOGCFCDZRPEM-UHFFFAOYSA-N |
Product Overview
4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride (CAS 54237-25-1), with molecular formula C20H20ClNO and molecular weight 325.12 g/mol. IUPAC: 3,5-dibenzylidene-1-methylpiperidin-4-one;hydrochloride.
Chemical Property Profile of 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride
Property Insights of 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride
The XLogP value of 4.0899 indicates that 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride has 1 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 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride?
The CAS number of 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride is 54237-25-1.
What is the molecular formula of 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride?
The molecular formula of 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride is C20H20ClNO.
What is the molecular weight of 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride?
The molecular weight of 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride is 325.12 g/mol.
Where can I buy 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride?
You can request a quote for 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Piperidinone, 1-methyl-3,5-bis(phenylmethylene)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.