AF-399/41503053
TL;DR: AF-399/41503053 (CAS 433309-74-1) is a chemical compound with molecular formula C21H18Cl3NO4 and molecular weight 453.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-5-(3,4-dichlorophenyl)-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Also Known As: AF-399/41503053, 4-(4-chlorobenzoyl)-5-(3,4-dichlorophenyl)-3-hydroxy-1-(3-methoxypropyl)-1,5-dihydro-2H-pyrrol-2-one, (4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-5-(3,4-dichlorophenyl)-1-(3-methoxypropyl)pyrrolidine-2,3-dione, 4-(4-chlorobenzoyl)-5-(3,4-dichlorophenyl)-3-hydroxy-1-(3-methoxypropyl)-1H-pyrrol-2(5H)-one, (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(3,4-dichlorophenyl)-1-(3-methoxypropyl)pyrrolidine-2,3-dione
| Molecular Formula | C21H18Cl3NO4 |
|---|---|
| Molecular Weight | 453.03 g/mol |
| LogP | 5.105 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 453.03015 |
| Heavy Atoms | 29 |
| Complexity | 972.39154 |
Chemical Identifiers
| CAS Number | 433309-74-1 |
|---|---|
| SMILES | COCCCN1C(/C(=C(/C2=CC=C(C=C2)Cl)\O)/C(=O)C1=O)C3=CC(=C(C=C3)Cl)Cl |
Product Overview
AF-399/41503053 (CAS 433309-74-1), with molecular formula C21H18Cl3NO4 and molecular weight 453.03 g/mol. IUPAC: (4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-5-(3,4-dichlorophenyl)-1-(3-methoxypropyl)pyrrolidine-2,3-dione.
Chemical Property Profile of AF-399/41503053
Property Insights of AF-399/41503053
The XLogP value of 5.105 indicates that AF-399/41503053 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/41503053. Following Lipinski's Rule of Five, AF-399/41503053 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/41503053?
The CAS number of AF-399/41503053 is 433309-74-1.
What is the molecular formula of AF-399/41503053?
The molecular formula of AF-399/41503053 is C21H18Cl3NO4.
What is the molecular weight of AF-399/41503053?
The molecular weight of AF-399/41503053 is 453.03 g/mol.
Where can I buy AF-399/41503053?
You can request a quote for AF-399/41503053 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41503053?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41503053 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.