4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide
TL;DR: 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide (CAS 329919-45-1) is a chemical compound with molecular formula C21H27NO2 and molecular weight 325.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide
Also Known As: BAS 00435919, 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide, BRD-K69657427-001-01-3, 4-tert-Butyl-N-[2-(3,4-dimethyl-phenoxy)-ethyl]-benzamide, [4-(tert-butyl)phenyl]-N-[2-(3,4-dimethylphenoxy)ethyl]carboxamide
| Molecular Formula | C21H27NO2 |
|---|---|
| Molecular Weight | 325.20 g/mol |
| LogP | 4.40974 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.2042 |
| Heavy Atoms | 24 |
| Complexity | 696.7689 |
Chemical Identifiers
| CAS Number | 329919-45-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)OCCNC(=O)C2=CC=C(C=C2)C(C)(C)C)C |
Product Overview
4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide (CAS 329919-45-1), with molecular formula C21H27NO2 and molecular weight 325.20 g/mol. IUPAC: 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide.
Chemical Property Profile of 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide
Property Insights of 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide
The XLogP value of 4.40974 indicates that 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide 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-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide?
The CAS number of 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide is 329919-45-1.
What is the molecular formula of 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide?
The molecular formula of 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide is C21H27NO2.
What is the molecular weight of 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide?
The molecular weight of 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide is 325.20 g/mol.
Where can I buy 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide?
You can request a quote for 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide 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-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-tert-butyl-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.