4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide
TL;DR: 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide (CAS 547698-89-5) is a chemical compound with molecular formula C17H17ClFNO and molecular weight 305.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide
Also Known As: 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide, AB00310249-03, [4-(tert-butyl)phenyl]-N-(4-chloro-2-fluorophenyl)carboxamide
| Molecular Formula | C17H17ClFNO |
|---|---|
| Molecular Weight | 305.10 g/mol |
| LogP | 5.0289 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 305.09827 |
| Heavy Atoms | 21 |
| Complexity | 659.4806 |
Chemical Identifiers
| CAS Number | 547698-89-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)Cl)F |
Product Overview
4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide (CAS 547698-89-5), with molecular formula C17H17ClFNO and molecular weight 305.10 g/mol. IUPAC: 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide.
Chemical Property Profile of 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide
Property Insights of 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide
The XLogP value of 5.0289 indicates that 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide has 1 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 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide?
The CAS number of 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide is 547698-89-5.
What is the molecular formula of 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide?
The molecular formula of 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide is C17H17ClFNO.
What is the molecular weight of 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide?
The molecular weight of 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide is 305.10 g/mol.
Where can I buy 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide?
You can request a quote for 4-tert-butyl-N-(4-chloro-2-fluorophenyl)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-(4-chloro-2-fluorophenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-tert-butyl-N-(4-chloro-2-fluorophenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.