1-(4-Tert-butylbenzoyl)-3-phenylpiperidine
TL;DR: 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine (CAS 404022-87-3) is a chemical compound with molecular formula C22H27NO and molecular weight 321.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-tert-butylphenyl)-(3-phenylpiperidin-1-yl)methanone
Also Known As: 1-(4-tert-butylbenzoyl)-3-phenylpiperidine, (4-tert-butylphenyl)(3-phenylpiperidin-1-yl)methanone, (4-tert-butylphenyl)-(3-phenylpiperidin-1-yl)methanone, AO-365/15162133
| Molecular Formula | C22H27NO |
|---|---|
| Molecular Weight | 321.21 g/mol |
| LogP | 5.0039 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.20926 |
| Heavy Atoms | 24 |
| Complexity | 682.1599 |
Chemical Identifiers
| CAS Number | 404022-87-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCCC(C2)C3=CC=CC=C3 |
Product Overview
1-(4-Tert-butylbenzoyl)-3-phenylpiperidine (CAS 404022-87-3), with molecular formula C22H27NO and molecular weight 321.21 g/mol. IUPAC: (4-tert-butylphenyl)-(3-phenylpiperidin-1-yl)methanone.
Chemical Property Profile of 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine
Property Insights of 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine
The XLogP value of 5.0039 indicates that 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine?
The CAS number of 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine is 404022-87-3.
What is the molecular formula of 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine?
The molecular formula of 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine is C22H27NO.
What is the molecular weight of 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine?
The molecular weight of 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine is 321.21 g/mol.
Where can I buy 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine?
You can request a quote for 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Tert-butylbenzoyl)-3-phenylpiperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.