N-butyl-N-ethyl-4-fluorobenzamide
TL;DR: N-butyl-N-ethyl-4-fluorobenzamide (CAS 90172-56-8) is a chemical compound with molecular formula C13H18FNO and molecular weight 223.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-N-ethyl-4-fluorobenzamide
Also Known As: N-butyl-N-ethyl-4-fluorobenzamide, N-butyl-N-ethyl(4-fluorophenyl)carboxamide
| Molecular Formula | C13H18FNO |
|---|---|
| Molecular Weight | 223.14 g/mol |
| LogP | 3.0879 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 223.13724 |
| Heavy Atoms | 16 |
| Complexity | 334.29077 |
Chemical Identifiers
| CAS Number | 90172-56-8 |
|---|---|
| SMILES | CCCCN(CC)C(=O)C1=CC=C(C=C1)F |
Product Overview
N-butyl-N-ethyl-4-fluorobenzamide (CAS 90172-56-8), with molecular formula C13H18FNO and molecular weight 223.14 g/mol. IUPAC: N-butyl-N-ethyl-4-fluorobenzamide.
Chemical Property Profile of N-butyl-N-ethyl-4-fluorobenzamide
Property Insights of N-butyl-N-ethyl-4-fluorobenzamide
The XLogP value of 3.0879 indicates that N-butyl-N-ethyl-4-fluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, N-butyl-N-ethyl-4-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butyl-N-ethyl-4-fluorobenzamide has 0 hydrogen bond donor(s) and 1 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 N-butyl-N-ethyl-4-fluorobenzamide?
The CAS number of N-butyl-N-ethyl-4-fluorobenzamide is 90172-56-8.
What is the molecular formula of N-butyl-N-ethyl-4-fluorobenzamide?
The molecular formula of N-butyl-N-ethyl-4-fluorobenzamide is C13H18FNO.
What is the molecular weight of N-butyl-N-ethyl-4-fluorobenzamide?
The molecular weight of N-butyl-N-ethyl-4-fluorobenzamide is 223.14 g/mol.
Where can I buy N-butyl-N-ethyl-4-fluorobenzamide?
You can request a quote for N-butyl-N-ethyl-4-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-N-ethyl-4-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-N-ethyl-4-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.