BAS 03539873
TL;DR: BAS 03539873 (CAS 488724-76-1) is a chemical compound with molecular formula C26H30N2O5 and molecular weight 450.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy-(4-methoxy-2-methylphenyl)methylidene]-1-(3-morpholin-4-ylpropyl)-5-phenylpyrrolidine-2,3-dione
Also Known As: BAS 03539873, AO-022/41320094, 3-hydroxy-4-(4-methoxy-2-methylbenzoyl)-1-[3-(4-morpholinyl)propyl]-5-phenyl-1,5-dihydro-2H-pyrrol-2-one, (4E)-4-[hydroxy-(4-methoxy-2-methylphenyl)methylidene]-1-(3-morpholin-4-ylpropyl)-5-phenylpyrrolidine-2,3-dione, 3-hydroxy-4-(4-methoxy-2-methylbenzoyl)-1-(3-morpholinopropyl)-5-phenyl-1H-pyrrol-2(5H)-one
| Molecular Formula | C26H30N2O5 |
|---|---|
| Molecular Weight | 450.22 g/mol |
| LogP | 3.14762 |
| Topological Polar Surface Area | 79.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 450.21548 |
| Heavy Atoms | 33 |
| Complexity | 1043.9027 |
Chemical Identifiers
| CAS Number | 488724-76-1 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OC)/C(=C\2/C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC=CC=C4)/O |
Product Overview
BAS 03539873 (CAS 488724-76-1), with molecular formula C26H30N2O5 and molecular weight 450.22 g/mol. IUPAC: (4E)-4-[hydroxy-(4-methoxy-2-methylphenyl)methylidene]-1-(3-morpholin-4-ylpropyl)-5-phenylpyrrolidine-2,3-dione.
Chemical Property Profile of BAS 03539873
Property Insights of BAS 03539873
The XLogP value of 3.14762 indicates that BAS 03539873 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 BAS 03539873. Following Lipinski's Rule of Five, BAS 03539873 has 1 hydrogen bond donor(s) and 6 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 BAS 03539873?
The CAS number of BAS 03539873 is 488724-76-1.
What is the molecular formula of BAS 03539873?
The molecular formula of BAS 03539873 is C26H30N2O5.
What is the molecular weight of BAS 03539873?
The molecular weight of BAS 03539873 is 450.22 g/mol.
Where can I buy BAS 03539873?
You can request a quote for BAS 03539873 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03539873?
Yes, KEHONG BIO provides custom synthesis services for BAS 03539873 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.