AF-399/42100453
TL;DR: AF-399/42100453 (CAS 371141-83-2) is a chemical compound with molecular formula C26H24N2O4 and molecular weight 428.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-5-(4-methylphenyl)-1-pyridin-2-ylpyrrolidine-2,3-dione
Also Known As: AF-399/42100453, 3-hydroxy-4-(4-isopropoxybenzoyl)-1-(pyridin-2-yl)-5-(p-tolyl)-1H-pyrrol-2(5H)-one, (4E)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-5-(4-methylphenyl)-1-pyridin-2-ylpyrrolidine-2,3-dione, (4E)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-5-(4-methylphenyl)-1-(pyridin-2-yl)pyrrolidine-2,3-dione, 3-hydroxy-4-(4-isopropoxybenzoyl)-5-(4-methylphenyl)-1-(2-pyridinyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C26H24N2O4 |
|---|---|
| Molecular Weight | 428.17 g/mol |
| LogP | 4.80352 |
| Topological Polar Surface Area | 79.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.1736 |
| Heavy Atoms | 32 |
| Complexity | 1166.7135 |
Chemical Identifiers
| CAS Number | 371141-83-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)OC(C)C)\O)/C(=O)C(=O)N2C4=CC=CC=N4 |
Product Overview
AF-399/42100453 (CAS 371141-83-2), with molecular formula C26H24N2O4 and molecular weight 428.17 g/mol. IUPAC: (4E)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-5-(4-methylphenyl)-1-pyridin-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of AF-399/42100453
Property Insights of AF-399/42100453
The XLogP value of 4.80352 indicates that AF-399/42100453 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.73 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/42100453. Following Lipinski's Rule of Five, AF-399/42100453 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-399/42100453?
The CAS number of AF-399/42100453 is 371141-83-2.
What is the molecular formula of AF-399/42100453?
The molecular formula of AF-399/42100453 is C26H24N2O4.
What is the molecular weight of AF-399/42100453?
The molecular weight of AF-399/42100453 is 428.17 g/mol.
Where can I buy AF-399/42100453?
You can request a quote for AF-399/42100453 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/42100453?
Yes, KEHONG BIO provides custom synthesis services for AF-399/42100453 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.