BAS 06024031
TL;DR: BAS 06024031 (CAS 609312-63-2) is a chemical compound with molecular formula C22H18N2O4S and molecular weight 406.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy-(3-methoxyphenyl)methylidene]-1-(pyridin-3-ylmethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione
Also Known As: BAS 06024031, (4E)-4-[hydroxy-(3-methoxyphenyl)methylidene]-1-(pyridin-3-ylmethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione, 3-hydroxy-4-(3-methoxybenzoyl)-1-(pyridin-3-ylmethyl)-5-(thiophen-2-yl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C22H18N2O4S |
|---|---|
| Molecular Weight | 406.10 g/mol |
| LogP | 3.7736 |
| Topological Polar Surface Area | 79.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.09872 |
| Heavy Atoms | 29 |
| Complexity | 1077.2113 |
Chemical Identifiers
| CAS Number | 609312-63-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)CC3=CN=CC=C3)C4=CC=CS4)/O |
Product Overview
BAS 06024031 (CAS 609312-63-2), with molecular formula C22H18N2O4S and molecular weight 406.10 g/mol. IUPAC: (4E)-4-[hydroxy-(3-methoxyphenyl)methylidene]-1-(pyridin-3-ylmethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of BAS 06024031
Property Insights of BAS 06024031
The XLogP value of 3.7736 indicates that BAS 06024031 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.73 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06024031. Following Lipinski's Rule of Five, BAS 06024031 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 06024031?
The CAS number of BAS 06024031 is 609312-63-2.
What is the molecular formula of BAS 06024031?
The molecular formula of BAS 06024031 is C22H18N2O4S.
What is the molecular weight of BAS 06024031?
The molecular weight of BAS 06024031 is 406.10 g/mol.
Where can I buy BAS 06024031?
You can request a quote for BAS 06024031 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06024031?
Yes, KEHONG BIO provides custom synthesis services for BAS 06024031 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.