AE-848/42024958
TL;DR: AE-848/42024958 (CAS 423141-32-6) is a chemical compound with molecular formula C22H19ClFNO4 and molecular weight 415.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 1-[(4-chlorophenyl)methyl]-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylate
Also Known As: AE-848/42024958, dimethyl 1-(4-chlorobenzyl)-4-(4-fluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, dimethyl 1-[(4-chlorophenyl)methyl]-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylate, dimethyl 1-(4-chlorobenzyl)-4-(4-fluorophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate, 3,5-DIMETHYL 1-[(4-CHLOROPHENYL)METHYL]-4-(4-FLUOROPHENYL)-1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLATE
| Molecular Formula | C22H19ClFNO4 |
|---|---|
| Molecular Weight | 415.10 g/mol |
| LogP | 4.1923 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 415.09866 |
| Heavy Atoms | 29 |
| Complexity | 933.3117 |
Chemical Identifiers
| CAS Number | 423141-32-6 |
|---|---|
| SMILES | COC(=O)C1=CN(C=C(C1C2=CC=C(C=C2)F)C(=O)OC)CC3=CC=C(C=C3)Cl |
Product Overview
AE-848/42024958 (CAS 423141-32-6), with molecular formula C22H19ClFNO4 and molecular weight 415.10 g/mol. IUPAC: dimethyl 1-[(4-chlorophenyl)methyl]-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylate.
Chemical Property Profile of AE-848/42024958
Property Insights of AE-848/42024958
The XLogP value of 4.1923 indicates that AE-848/42024958 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, AE-848/42024958 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AE-848/42024958 has 0 hydrogen bond donor(s) and 5 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 AE-848/42024958?
The CAS number of AE-848/42024958 is 423141-32-6.
What is the molecular formula of AE-848/42024958?
The molecular formula of AE-848/42024958 is C22H19ClFNO4.
What is the molecular weight of AE-848/42024958?
The molecular weight of AE-848/42024958 is 415.10 g/mol.
Where can I buy AE-848/42024958?
You can request a quote for AE-848/42024958 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/42024958?
Yes, KEHONG BIO provides custom synthesis services for AE-848/42024958 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.