AF-399/41902505
TL;DR: AF-399/41902505 (CAS 618081-35-9) is a chemical compound with molecular formula C27H32N2O5 and molecular weight 464.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy-(4-methylphenyl)methylidene]-1-(2-morpholin-4-ylethyl)-5-(4-propoxyphenyl)pyrrolidine-2,3-dione
Also Known As: AF-399/41902505, (4E)-4-[hydroxy-(4-methylphenyl)methylidene]-1-(2-morpholin-4-ylethyl)-5-(4-propoxyphenyl)pyrrolidine-2,3-dione, (E)-(4-methylphenyl)-[1-(2-morpholin-4-ium-4-ylethyl)-4,5-dioxo-2-(4-propoxyphenyl)pyrrolidin-3-ylidene]methanolate, 3-hydroxy-4-(4-methylbenzoyl)-1-[2-(4-morpholinyl)ethyl]-5-(4-propoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one, 3-hydroxy-4-(4-methylbenzoyl)-1-(2-morpholinoethyl)-5-(4-propoxyphenyl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C27H32N2O5 |
|---|---|
| Molecular Weight | 464.23 g/mol |
| LogP | 3.53772 |
| Topological Polar Surface Area | 79.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 464.2311 |
| Heavy Atoms | 34 |
| Complexity | 1039.6951 |
Chemical Identifiers
| CAS Number | 618081-35-9 |
|---|---|
| SMILES | CCCOC1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)C)\O)/C(=O)C(=O)N2CCN4CCOCC4 |
Product Overview
AF-399/41902505 (CAS 618081-35-9), with molecular formula C27H32N2O5 and molecular weight 464.23 g/mol. IUPAC: (4E)-4-[hydroxy-(4-methylphenyl)methylidene]-1-(2-morpholin-4-ylethyl)-5-(4-propoxyphenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of AF-399/41902505
Property Insights of AF-399/41902505
The XLogP value of 3.53772 indicates that AF-399/41902505 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-399/41902505. Following Lipinski's Rule of Five, AF-399/41902505 has 1 hydrogen bond donor(s) and 6 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-399/41902505?
The CAS number of AF-399/41902505 is 618081-35-9.
What is the molecular formula of AF-399/41902505?
The molecular formula of AF-399/41902505 is C27H32N2O5.
What is the molecular weight of AF-399/41902505?
The molecular weight of AF-399/41902505 is 464.23 g/mol.
Where can I buy AF-399/41902505?
You can request a quote for AF-399/41902505 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41902505?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41902505 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.