BAS 03321647
TL;DR: BAS 03321647 (CAS 440097-00-7) is a chemical compound with molecular formula C16H19NO4 and molecular weight 289.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-4-hydroxy-1-(2-methoxyethyl)-2-(4-methylphenyl)-2H-pyrrol-5-one
Also Known As: BAS 03321647, 3-acetyl-4-hydroxy-1-(2-methoxyethyl)-2-(4-methylphenyl)-2H-pyrrol-5-one, 4-acetyl-3-hydroxy-1-(2-methoxyethyl)-5-(p-tolyl)-1H-pyrrol-2(5H)-one, (4E)-4-(1-hydroxyethylidene)-1-(2-methoxyethyl)-5-(4-methylphenyl)pyrrolidine-2,3-dione, 4-Acetyl-3-hydroxy-1-(2-methoxy-ethyl)-5-p-tolyl-1,5-dihydro-pyrrol-2-one
| Molecular Formula | C16H19NO4 |
|---|---|
| Molecular Weight | 289.13 g/mol |
| LogP | 1.92582 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 289.1314 |
| Heavy Atoms | 21 |
| Complexity | 588.7995 |
Chemical Identifiers
| CAS Number | 440097-00-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2C(=C(C(=O)N2CCOC)O)C(=O)C |
Product Overview
BAS 03321647 (CAS 440097-00-7), with molecular formula C16H19NO4 and molecular weight 289.13 g/mol. IUPAC: 3-acetyl-4-hydroxy-1-(2-methoxyethyl)-2-(4-methylphenyl)-2H-pyrrol-5-one.
Chemical Property Profile of BAS 03321647
Property Insights of BAS 03321647
The XLogP value of 1.92582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03321647. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03321647. Following Lipinski's Rule of Five, BAS 03321647 has 1 hydrogen bond donor(s) and 4 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 03321647?
The CAS number of BAS 03321647 is 440097-00-7.
What is the molecular formula of BAS 03321647?
The molecular formula of BAS 03321647 is C16H19NO4.
What is the molecular weight of BAS 03321647?
The molecular weight of BAS 03321647 is 289.13 g/mol.
Where can I buy BAS 03321647?
You can request a quote for BAS 03321647 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03321647?
Yes, KEHONG BIO provides custom synthesis services for BAS 03321647 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.