AQ-149/42667080
TL;DR: AQ-149/42667080 (CAS 425626-49-9) is a chemical compound with molecular formula C21H18ClNO4 and molecular weight 383.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-5-(4-methoxyphenyl)-1-prop-2-enylpyrrolidine-2,3-dione
Also Known As: AQ-149/42667080, 1-allyl-4-(4-chlorobenzoyl)-3-hydroxy-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one, (4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-5-(4-methoxyphenyl)-1-prop-2-enylpyrrolidine-2,3-dione, 1-allyl-4-(4-chlorobenzoyl)-3-hydroxy-5-(4-methoxyphenyl)-1H-pyrrol-2(5H)-one, 4-[(4-chlorophenyl)carbonyl]-3-hydroxy-5-(4-methoxyphenyl)-1-(prop-2-en-1-yl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C21H18ClNO4 |
|---|---|
| Molecular Weight | 383.09 g/mol |
| LogP | 3.9563 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 383.09244 |
| Heavy Atoms | 27 |
| Complexity | 916.2027 |
Chemical Identifiers
| CAS Number | 425626-49-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)Cl)\O)/C(=O)C(=O)N2CC=C |
Product Overview
AQ-149/42667080 (CAS 425626-49-9), with molecular formula C21H18ClNO4 and molecular weight 383.09 g/mol. IUPAC: (4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-5-(4-methoxyphenyl)-1-prop-2-enylpyrrolidine-2,3-dione.
Chemical Property Profile of AQ-149/42667080
Property Insights of AQ-149/42667080
The XLogP value of 3.9563 indicates that AQ-149/42667080 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-149/42667080. Following Lipinski's Rule of Five, AQ-149/42667080 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 AQ-149/42667080?
The CAS number of AQ-149/42667080 is 425626-49-9.
What is the molecular formula of AQ-149/42667080?
The molecular formula of AQ-149/42667080 is C21H18ClNO4.
What is the molecular weight of AQ-149/42667080?
The molecular weight of AQ-149/42667080 is 383.09 g/mol.
Where can I buy AQ-149/42667080?
You can request a quote for AQ-149/42667080 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-149/42667080?
Yes, KEHONG BIO provides custom synthesis services for AQ-149/42667080 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.