4-Tert-butyl-N-(2-fluorophenyl)benzamide
TL;DR: 4-Tert-butyl-N-(2-fluorophenyl)benzamide (CAS 312704-52-2) is a chemical compound with molecular formula C17H18FNO and molecular weight 271.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-(2-fluorophenyl)benzamide
Also Known As: 4-tert-butyl-N-(2-fluorophenyl)benzamide, BAS 00368806, 4-tert-Butyl-N-(2-fluoro-phenyl)-benzamide, AB00081256-01, AB00081256-03
| Molecular Formula | C17H18FNO |
|---|---|
| Molecular Weight | 271.14 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.13724 |
| Heavy Atoms | 20 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 312704-52-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2F |
| InChIKey | YRZSURUFPRQDNT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Tert-butyl-N-(2-fluorophenyl)benzamide (CAS 312704-52-2), with molecular formula C17H18FNO and molecular weight 271.14 g/mol. IUPAC: 4-tert-butyl-N-(2-fluorophenyl)benzamide.
Chemical Property Profile of 4-Tert-butyl-N-(2-fluorophenyl)benzamide
Property Insights of 4-Tert-butyl-N-(2-fluorophenyl)benzamide
The XLogP value of 4.3 indicates that 4-Tert-butyl-N-(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-(2-fluorophenyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Tert-butyl-N-(2-fluorophenyl)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-fluorophenyl)benzamide?
The CAS number of 4-Tert-butyl-N-(2-fluorophenyl)benzamide is 312704-52-2.
What is the molecular formula of 4-Tert-butyl-N-(2-fluorophenyl)benzamide?
The molecular formula of 4-Tert-butyl-N-(2-fluorophenyl)benzamide is C17H18FNO.
What is the molecular weight of 4-Tert-butyl-N-(2-fluorophenyl)benzamide?
The molecular weight of 4-Tert-butyl-N-(2-fluorophenyl)benzamide is 271.14 g/mol.
Where can I buy 4-Tert-butyl-N-(2-fluorophenyl)benzamide?
You can request a quote for 4-Tert-butyl-N-(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-(2-fluorophenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Tert-butyl-N-(2-fluorophenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.