AF-399/41703714
TL;DR: AF-399/41703714 (CAS 497075-62-4) is a chemical compound with molecular formula C30H38N2O5 and molecular weight 506.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-butoxy-2-methylphenyl)-hydroxymethylidene]-5-(4-methylphenyl)-1-(3-morpholin-4-ylpropyl)pyrrolidine-2,3-dione
Also Known As: AF-399/41703714, (4E)-4-[(4-butoxy-2-methylphenyl)-hydroxymethylidene]-5-(4-methylphenyl)-1-(3-morpholin-4-ylpropyl)pyrrolidine-2,3-dione, (E)-(4-butoxy-2-methylphenyl)-[2-(4-methylphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)-4,5-dioxopyrrolidin-3-ylidene]methanolate, 4-(4-butoxy-2-methylbenzoyl)-3-hydroxy-5-(4-methylphenyl)-1-(3-morpholin-4-ylpropyl)-1,5-dihydro-2H-pyrrol-2-one, 4-(4-butoxy-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(p-tolyl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C30H38N2O5 |
|---|---|
| Molecular Weight | 506.28 g/mol |
| LogP | 4.62634 |
| Topological Polar Surface Area | 79.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 506.27808 |
| Heavy Atoms | 37 |
| Complexity | 1135.1608 |
Chemical Identifiers
| CAS Number | 497075-62-4 |
|---|---|
| SMILES | CCCCOC1=CC(=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC=C(C=C4)C)/O)C |
Product Overview
AF-399/41703714 (CAS 497075-62-4), with molecular formula C30H38N2O5 and molecular weight 506.28 g/mol. IUPAC: (4E)-4-[(4-butoxy-2-methylphenyl)-hydroxymethylidene]-5-(4-methylphenyl)-1-(3-morpholin-4-ylpropyl)pyrrolidine-2,3-dione.
Chemical Property Profile of AF-399/41703714
Property Insights of AF-399/41703714
The XLogP value of 4.62634 indicates that AF-399/41703714 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-399/41703714. Following Lipinski's Rule of Five, AF-399/41703714 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/41703714?
The CAS number of AF-399/41703714 is 497075-62-4.
What is the molecular formula of AF-399/41703714?
The molecular formula of AF-399/41703714 is C30H38N2O5.
What is the molecular weight of AF-399/41703714?
The molecular weight of AF-399/41703714 is 506.28 g/mol.
Where can I buy AF-399/41703714?
You can request a quote for AF-399/41703714 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41703714?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41703714 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.