4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine
TL;DR: 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine (CAS 333348-41-7) is a chemical compound with molecular formula C21H25NO and molecular weight 307.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-benzylpiperidin-1-yl)-(3,4-dimethylphenyl)methanone
Also Known As: 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine, 3,4-dimethylphenyl 4-benzylpiperidyl ketone, 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine #, 3,4-Dimethylbenzoic acid, 4-benzylpiperidylamide, (4-benzylpiperidin-1-yl)-(3,4-dimethylphenyl)methanone
| Molecular Formula | C21H25NO |
|---|---|
| Molecular Weight | 307.19 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.1936 |
| Heavy Atoms | 23 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 333348-41-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)C |
| InChIKey | WCQBLWHXLCSILD-UHFFFAOYSA-N |
Product Overview
4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine (CAS 333348-41-7), with molecular formula C21H25NO and molecular weight 307.19 g/mol. IUPAC: (4-benzylpiperidin-1-yl)-(3,4-dimethylphenyl)methanone.
Chemical Property Profile of 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine
Property Insights of 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine
The XLogP value of 4.8 indicates that 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine 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-Benzyl-1-(3,4-dimethylbenzoyl)piperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine has 0 hydrogen bond donor(s) and 1 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-Benzyl-1-(3,4-dimethylbenzoyl)piperidine?
The CAS number of 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine is 333348-41-7.
What is the molecular formula of 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine?
The molecular formula of 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine is C21H25NO.
What is the molecular weight of 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine?
The molecular weight of 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine is 307.19 g/mol.
Where can I buy 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine?
You can request a quote for 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzyl-1-(3,4-dimethylbenzoyl)piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.