AF-399/41901089
TL;DR: AF-399/41901089 (CAS 618377-61-0) is a chemical compound with molecular formula C23H18ClNO5 and molecular weight 423.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-1-(furan-2-ylmethyl)-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
Also Known As: AF-399/41901089, 4-(4-chlorobenzoyl)-1-(2-furylmethyl)-3-hydroxy-5-(3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one, (4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-1-(furan-2-ylmethyl)-5-(3-methoxyphenyl)pyrrolidine-2,3-dione, (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(furan-2-ylmethyl)-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
| Molecular Formula | C23H18ClNO5 |
|---|---|
| Molecular Weight | 423.09 g/mol |
| LogP | 4.5635 |
| Topological Polar Surface Area | 79.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.08734 |
| Heavy Atoms | 30 |
| Complexity | 1118.7599 |
Chemical Identifiers
| CAS Number | 618377-61-0 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C2/C(=C(/C3=CC=C(C=C3)Cl)\O)/C(=O)C(=O)N2CC4=CC=CO4 |
Product Overview
AF-399/41901089 (CAS 618377-61-0), with molecular formula C23H18ClNO5 and molecular weight 423.09 g/mol. IUPAC: (4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-1-(furan-2-ylmethyl)-5-(3-methoxyphenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of AF-399/41901089
Property Insights of AF-399/41901089
The XLogP value of 4.5635 indicates that AF-399/41901089 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.98 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/41901089. Following Lipinski's Rule of Five, AF-399/41901089 has 1 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 AF-399/41901089?
The CAS number of AF-399/41901089 is 618377-61-0.
What is the molecular formula of AF-399/41901089?
The molecular formula of AF-399/41901089 is C23H18ClNO5.
What is the molecular weight of AF-399/41901089?
The molecular weight of AF-399/41901089 is 423.09 g/mol.
Where can I buy AF-399/41901089?
You can request a quote for AF-399/41901089 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41901089?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41901089 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.