AQ-149/43372345
TL;DR: AQ-149/43372345 (CAS 577987-05-4) is a chemical compound with molecular formula C19H18BrNO5S and molecular weight 451.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-bromophenyl)-4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
Also Known As: AQ-149/43372345, 2-(3-bromophenyl)-4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one, 5-(3-bromophenyl)-3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-4-(2-thienylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one, (4E)-5-(3-bromophenyl)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(thiophen-2-yl)methylidene]pyrrolidine-2,3-dione, 5-(3-bromophenyl)-3-hydroxy-1-(2-(2-hydroxyethoxy)ethyl)-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C19H18BrNO5S |
|---|---|
| Molecular Weight | 451.01 g/mol |
| LogP | 3.0978 |
| Topological Polar Surface Area | 87.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 451.0089 |
| Heavy Atoms | 27 |
| Complexity | 864.74475 |
Chemical Identifiers
| CAS Number | 577987-05-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C2C(=C(C(=O)N2CCOCCO)O)C(=O)C3=CC=CS3 |
Product Overview
AQ-149/43372345 (CAS 577987-05-4), with molecular formula C19H18BrNO5S and molecular weight 451.01 g/mol. IUPAC: 2-(3-bromophenyl)-4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of AQ-149/43372345
Property Insights of AQ-149/43372345
The XLogP value of 3.0978 indicates that AQ-149/43372345 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.07 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-149/43372345. Following Lipinski's Rule of Five, AQ-149/43372345 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 AQ-149/43372345?
The CAS number of AQ-149/43372345 is 577987-05-4.
What is the molecular formula of AQ-149/43372345?
The molecular formula of AQ-149/43372345 is C19H18BrNO5S.
What is the molecular weight of AQ-149/43372345?
The molecular weight of AQ-149/43372345 is 451.01 g/mol.
Where can I buy AQ-149/43372345?
You can request a quote for AQ-149/43372345 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-149/43372345?
Yes, KEHONG BIO provides custom synthesis services for AQ-149/43372345 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.