AQ-149/12381478
TL;DR: AQ-149/12381478 (CAS 425608-54-4) is a chemical compound with molecular formula C27H25NO5 and molecular weight 443.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(3,4-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-(2-phenylethyl)pyrrolidine-2,3-dione
Also Known As: AQ-149/12381478, 4-benzoyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-phenylethyl)-1,5-dihydro-2H-pyrrol-2-one, (4E)-5-(3,4-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-(2-phenylethyl)pyrrolidine-2,3-dione, 4-benzoyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one, (4E)-5-(3,4-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-phenethylpyrrolidine-2,3-dione
| Molecular Formula | C27H25NO5 |
|---|---|
| Molecular Weight | 443.17 g/mol |
| LogP | 4.3682 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 443.17328 |
| Heavy Atoms | 33 |
| Complexity | 1187.6483 |
Chemical Identifiers
| CAS Number | 425608-54-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2/C(=C(/C3=CC=CC=C3)\O)/C(=O)C(=O)N2CCC4=CC=CC=C4)OC |
Product Overview
AQ-149/12381478 (CAS 425608-54-4), with molecular formula C27H25NO5 and molecular weight 443.17 g/mol. IUPAC: (4E)-5-(3,4-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-(2-phenylethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of AQ-149/12381478
Property Insights of AQ-149/12381478
The XLogP value of 4.3682 indicates that AQ-149/12381478 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.07 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-149/12381478. Following Lipinski's Rule of Five, AQ-149/12381478 has 1 hydrogen bond donor(s) and 5 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-149/12381478?
The CAS number of AQ-149/12381478 is 425608-54-4.
What is the molecular formula of AQ-149/12381478?
The molecular formula of AQ-149/12381478 is C27H25NO5.
What is the molecular weight of AQ-149/12381478?
The molecular weight of AQ-149/12381478 is 443.17 g/mol.
Where can I buy AQ-149/12381478?
You can request a quote for AQ-149/12381478 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-149/12381478?
Yes, KEHONG BIO provides custom synthesis services for AQ-149/12381478 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.