BAS 03539494
TL;DR: BAS 03539494 (CAS 384365-99-5) is a chemical compound with molecular formula C20H20N2O7 and molecular weight 400.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-1-(3-methoxypropyl)-3-(5-methylfuran-2-carbonyl)-2-(4-nitrophenyl)-2H-pyrrol-5-one
Also Known As: BAS 03539494, (4E)-4-[hydroxy(5-methylfuran-2-yl)methylidene]-1-(3-methoxypropyl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione, 3-hydroxy-1-(3-methoxypropyl)-4-(5-methyl-2-furoyl)-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one, 3-hydroxy-1-(3-methoxypropyl)-4-(5-methylfuran-2-carbonyl)-5-(4-nitrophenyl)-1H-pyrrol-2(5H)-one, 3-hydroxy-1-(3-methoxypropyl)-4-[(5-methylfuran-2-yl)carbonyl]-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C20H20N2O7 |
|---|---|
| Molecular Weight | 400.13 g/mol |
| LogP | 3.11102 |
| Topological Polar Surface Area | 123.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 400.12704 |
| Heavy Atoms | 29 |
| Complexity | 974.9709 |
Chemical Identifiers
| CAS Number | 384365-99-5 |
|---|---|
| SMILES | CC1=CC=C(O1)C(=O)C2=C(C(=O)N(C2C3=CC=C(C=C3)[N+](=O)[O-])CCCOC)O |
Product Overview
BAS 03539494 (CAS 384365-99-5), with molecular formula C20H20N2O7 and molecular weight 400.13 g/mol. IUPAC: 4-hydroxy-1-(3-methoxypropyl)-3-(5-methylfuran-2-carbonyl)-2-(4-nitrophenyl)-2H-pyrrol-5-one.
Chemical Property Profile of BAS 03539494
Property Insights of BAS 03539494
The XLogP value of 3.11102 indicates that BAS 03539494 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.12 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03539494. Following Lipinski's Rule of Five, BAS 03539494 has 1 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 03539494?
The CAS number of BAS 03539494 is 384365-99-5.
What is the molecular formula of BAS 03539494?
The molecular formula of BAS 03539494 is C20H20N2O7.
What is the molecular weight of BAS 03539494?
The molecular weight of BAS 03539494 is 400.13 g/mol.
Where can I buy BAS 03539494?
You can request a quote for BAS 03539494 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03539494?
Yes, KEHONG BIO provides custom synthesis services for BAS 03539494 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.