BAS 03539287
TL;DR: BAS 03539287 (CAS 489422-27-7) is a chemical compound with molecular formula C21H23NO7 and molecular weight 401.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-1-(2-methoxyethyl)-3-(5-methylfuran-2-carbonyl)-2H-pyrrol-5-one
Also Known As: BAS 03539287, AO-022/41503364, 5-(3-ethoxy-4-hydroxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-4-(5-methyl-2-furoyl)-1,5-dihydro-2H-pyrrol-2-one, 2-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-1-(2-methoxyethyl)-3-(5-methylfuran-2-carbonyl)-2H-pyrrol-5-one, (4E)-5-(3-ethoxy-4-hydroxyphenyl)-4-[hydroxy(5-methylfuran-2-yl)methylidene]-1-(2-methoxyethyl)pyrrolidine-2,3-dione
| Molecular Formula | C21H23NO7 |
|---|---|
| Molecular Weight | 401.15 g/mol |
| LogP | 2.91702 |
| Topological Polar Surface Area | 109.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 401.14746 |
| Heavy Atoms | 29 |
| Complexity | 959.6893 |
Chemical Identifiers
| CAS Number | 489422-27-7 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2CCOC)O)C(=O)C3=CC=C(O3)C)O |
Product Overview
BAS 03539287 (CAS 489422-27-7), with molecular formula C21H23NO7 and molecular weight 401.15 g/mol. IUPAC: 2-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-1-(2-methoxyethyl)-3-(5-methylfuran-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of BAS 03539287
Property Insights of BAS 03539287
The XLogP value of 2.91702 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03539287. The TPSA of 109.44 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03539287. Following Lipinski's Rule of Five, BAS 03539287 has 2 hydrogen bond donor(s) and 7 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 03539287?
The CAS number of BAS 03539287 is 489422-27-7.
What is the molecular formula of BAS 03539287?
The molecular formula of BAS 03539287 is C21H23NO7.
What is the molecular weight of BAS 03539287?
The molecular weight of BAS 03539287 is 401.15 g/mol.
Where can I buy BAS 03539287?
You can request a quote for BAS 03539287 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03539287?
Yes, KEHONG BIO provides custom synthesis services for BAS 03539287 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.