BAS 03539317
TL;DR: BAS 03539317 (CAS 488744-27-0) is a chemical compound with molecular formula C22H23NO6 and molecular weight 397.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-ethoxyphenyl)-hydroxymethylidene]-5-(3-hydroxyphenyl)-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Also Known As: BAS 03539317, 4-(4-ethoxybenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-(2-methoxyethyl)-1H-pyrrol-2(5H)-one, (4E)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-5-(3-hydroxyphenyl)-1-(2-methoxyethyl)pyrrolidine-2,3-dione, (4E)-4-[(4-ethoxyphenyl)-hydroxymethylidene]-5-(3-hydroxyphenyl)-1-(2-methoxyethyl)pyrrolidine-2,3-dione, 4-[(4-ethoxyphenyl)carbonyl]-3-hydroxy-5-(3-hydroxyphenyl)-1-(2-methoxyethyl)- 3-pyrrolin-2-one
| Molecular Formula | C22H23NO6 |
|---|---|
| Molecular Weight | 397.15 g/mol |
| LogP | 2.859 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 397.15253 |
| Heavy Atoms | 29 |
| Complexity | 934.5736 |
Chemical Identifiers
| CAS Number | 488744-27-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCOC)C3=CC(=CC=C3)O)/O |
Product Overview
BAS 03539317 (CAS 488744-27-0), with molecular formula C22H23NO6 and molecular weight 397.15 g/mol. IUPAC: (4E)-4-[(4-ethoxyphenyl)-hydroxymethylidene]-5-(3-hydroxyphenyl)-1-(2-methoxyethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of BAS 03539317
Property Insights of BAS 03539317
The XLogP value of 2.859 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03539317. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03539317. Following Lipinski's Rule of Five, BAS 03539317 has 2 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 03539317?
The CAS number of BAS 03539317 is 488744-27-0.
What is the molecular formula of BAS 03539317?
The molecular formula of BAS 03539317 is C22H23NO6.
What is the molecular weight of BAS 03539317?
The molecular weight of BAS 03539317 is 397.15 g/mol.
Where can I buy BAS 03539317?
You can request a quote for BAS 03539317 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03539317?
Yes, KEHONG BIO provides custom synthesis services for BAS 03539317 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.