4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone
TL;DR: 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone (CAS 330216-79-0) is a chemical compound with molecular formula C21H26N2O and molecular weight 322.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-tert-butylphenyl)-(4-phenylpiperazin-1-yl)methanone
Also Known As: 1-(4-tert-butylbenzoyl)-4-phenylpiperazine, 4-(tert-butyl)phenyl 4-phenylpiperazinyl ketone, (4-tert-butylphenyl)-(4-phenylpiperazin-1-yl)methanone, 4-(tert-Butyl)phenyl4-phenylpiperazinylketone, (4-tert-butylphenyl)(4-phenylpiperazin-1-yl)methanone
| Molecular Formula | C21H26N2O |
|---|---|
| Molecular Weight | 322.20 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.2045 |
| Heavy Atoms | 24 |
| Complexity | 406.0 |
Chemical Identifiers
| CAS Number | 330216-79-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3 |
| InChIKey | RZXGWGGNXRADRN-UHFFFAOYSA-N |
Product Overview
4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone (CAS 330216-79-0), with molecular formula C21H26N2O and molecular weight 322.20 g/mol. IUPAC: (4-tert-butylphenyl)-(4-phenylpiperazin-1-yl)methanone.
Chemical Property Profile of 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone
Property Insights of 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone
The XLogP value of 4.6 indicates that 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone 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 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone?
The CAS number of 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone is 330216-79-0.
What is the molecular formula of 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone?
The molecular formula of 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone is C21H26N2O.
What is the molecular weight of 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone?
The molecular weight of 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone is 322.20 g/mol.
Where can I buy 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone?
You can request a quote for 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone?
Yes, KEHONG BIO provides custom synthesis services for 4-(Tert-butyl)phenyl 4-phenylpiperazinyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.