AF-399/41115282
TL;DR: AF-399/41115282 (CAS 370574-99-5) is a chemical compound with molecular formula C20H13ClN2O3S and molecular weight 396.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(4-chlorophenyl)-4-[hydroxy(phenyl)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Also Known As: AF-399/41115282, (4E)-5-(4-chlorophenyl)-4-[hydroxy(phenyl)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione, 4-benzoyl-5-(4-chlorophenyl)-3-hydroxy-1-(1,3-thiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one, 4-benzoyl-5-(4-chlorophenyl)-3-hydroxy-1-(thiazol-2-yl)-1H-pyrrol-2(5H)-one, 5-(4-chlorophenyl)-3-hydroxy-4-(phenylcarbonyl)-1-(1,3-thiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C20H13ClN2O3S |
|---|---|
| Molecular Weight | 396.03 g/mol |
| LogP | 4.4228 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 396.03354 |
| Heavy Atoms | 27 |
| Complexity | 1030.8584 |
Chemical Identifiers
| CAS Number | 370574-99-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC=CS3)C4=CC=C(C=C4)Cl)/O |
Product Overview
AF-399/41115282 (CAS 370574-99-5), with molecular formula C20H13ClN2O3S and molecular weight 396.03 g/mol. IUPAC: (4E)-5-(4-chlorophenyl)-4-[hydroxy(phenyl)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione.
Chemical Property Profile of AF-399/41115282
Property Insights of AF-399/41115282
The XLogP value of 4.4228 indicates that AF-399/41115282 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/41115282. Following Lipinski's Rule of Five, AF-399/41115282 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-399/41115282?
The CAS number of AF-399/41115282 is 370574-99-5.
What is the molecular formula of AF-399/41115282?
The molecular formula of AF-399/41115282 is C20H13ClN2O3S.
What is the molecular weight of AF-399/41115282?
The molecular weight of AF-399/41115282 is 396.03 g/mol.
Where can I buy AF-399/41115282?
You can request a quote for AF-399/41115282 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41115282?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41115282 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.