AF-399/42047549
TL;DR: AF-399/42047549 (CAS 619271-44-2) is a chemical compound with molecular formula C24H28N2O5S and molecular weight 456.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-ethoxyphenyl)-4-hydroxy-1-(3-morpholin-4-ylpropyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
Also Known As: AF-399/42047549, 2-(3-ethoxyphenyl)-4-hydroxy-1-(3-morpholin-4-ylpropyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one, 5-(3-ethoxyphenyl)-3-hydroxy-1-[3-(4-morpholinyl)propyl]-4-(2-thienylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one, 5-(3-ethoxyphenyl)-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C24H28N2O5S |
|---|---|
| Molecular Weight | 456.17 g/mol |
| LogP | 3.4474 |
| Topological Polar Surface Area | 79.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 456.1719 |
| Heavy Atoms | 32 |
| Complexity | 982.0356 |
Chemical Identifiers
| CAS Number | 619271-44-2 |
|---|---|
| SMILES | CCOC1=CC=CC(=C1)C2C(=C(C(=O)N2CCCN3CCOCC3)O)C(=O)C4=CC=CS4 |
Product Overview
AF-399/42047549 (CAS 619271-44-2), with molecular formula C24H28N2O5S and molecular weight 456.17 g/mol. IUPAC: 2-(3-ethoxyphenyl)-4-hydroxy-1-(3-morpholin-4-ylpropyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of AF-399/42047549
Property Insights of AF-399/42047549
The XLogP value of 3.4474 indicates that AF-399/42047549 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.31 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/42047549. Following Lipinski's Rule of Five, AF-399/42047549 has 1 hydrogen bond donor(s) and 7 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 AF-399/42047549?
The CAS number of AF-399/42047549 is 619271-44-2.
What is the molecular formula of AF-399/42047549?
The molecular formula of AF-399/42047549 is C24H28N2O5S.
What is the molecular weight of AF-399/42047549?
The molecular weight of AF-399/42047549 is 456.17 g/mol.
Where can I buy AF-399/42047549?
You can request a quote for AF-399/42047549 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/42047549?
Yes, KEHONG BIO provides custom synthesis services for AF-399/42047549 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.