RefChem:203988
TL;DR: RefChem:203988 (CAS 161692-96-2) is a chemical compound with molecular formula C24H23F2NO3 and molecular weight 411.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxobutanoic acid;phenylmethanamine
Also Known As: Benzenemethanamine, (+-)-2',4'-difluoro-alpha-methyl-gamma-oxo(1,1'-biphenyl)-4-butanoate, (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with benzenemethanamine (1:1), 4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxobutanoic acid; phenylmethanamine, 4-(2',4'-Difluoro[1,1'-biphenyl]-4-yl)-2-methyl-4-oxobutanoic acid--1-phenylmethanamine (1/1), RefChem:203988
| Molecular Formula | C24H23F2NO3 |
|---|---|
| Molecular Weight | 411.16 g/mol |
| LogP | 5.0706 |
| Topological Polar Surface Area | 80.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.1646 |
| Heavy Atoms | 30 |
| Complexity | 989.0927 |
Chemical Identifiers
| CAS Number | 161692-96-2 |
|---|---|
| SMILES | CC(CC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)F)F)C(=O)O.C1=CC=C(C=C1)CN |
Product Overview
RefChem:203988 (CAS 161692-96-2), with molecular formula C24H23F2NO3 and molecular weight 411.16 g/mol. IUPAC: 4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxobutanoic acid;phenylmethanamine.
Chemical Property Profile of RefChem:203988
Property Insights of RefChem:203988
The XLogP value of 5.0706 indicates that RefChem:203988 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.39 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:203988. Following Lipinski's Rule of Five, RefChem:203988 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:203988?
The CAS number of RefChem:203988 is 161692-96-2.
What is the molecular formula of RefChem:203988?
The molecular formula of RefChem:203988 is C24H23F2NO3.
What is the molecular weight of RefChem:203988?
The molecular weight of RefChem:203988 is 411.16 g/mol.
Where can I buy RefChem:203988?
You can request a quote for RefChem:203988 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:203988?
Yes, KEHONG BIO provides custom synthesis services for RefChem:203988 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.