AB00096986-01
TL;DR: AB00096986-01 (CAS 332022-52-3) is a chemical compound with molecular formula C24H20N2O5 and molecular weight 416.14 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-pyridin-2-ylpyrrolidine-2,3-dione
Also Known As: AB00096986-01, 4-benzoyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(pyridin-2-yl)-1H-pyrrol-2(5H)-one, 5-(3,4-dimethoxyphenyl)-3-hydroxy-4-(phenylcarbonyl)-1-(pyridin-2-yl)-1,5-dihydro-2H-pyrrol-2-one, 5-(3,4-dimethoxyphenyl)-3-hydroxy-4-(phenylcarbonyl)-1-(2-pyridyl)-3-pyrrolin- 2-one, (4E)-5-(3,4-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-pyridin-2-ylpyrrolidine-2,3-dione
| Molecular Formula | C24H20N2O5 |
|---|---|
| Molecular Weight | 416.14 g/mol |
| LogP | 3.7251 |
| Topological Polar Surface Area | 88.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 416.1372 |
| Heavy Atoms | 31 |
| Complexity | 1159.1019 |
Chemical Identifiers
| CAS Number | 332022-52-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2/C(=C(/C3=CC=CC=C3)\O)/C(=O)C(=O)N2C4=CC=CC=N4)OC |
Product Overview
AB00096986-01 (CAS 332022-52-3), with molecular formula C24H20N2O5 and molecular weight 416.14 g/mol. IUPAC: (4E)-5-(3,4-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-pyridin-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of AB00096986-01
Property Insights of AB00096986-01
The XLogP value of 3.7251 indicates that AB00096986-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.96 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00096986-01. Following Lipinski's Rule of Five, AB00096986-01 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 AB00096986-01?
The CAS number of AB00096986-01 is 332022-52-3.
What is the molecular formula of AB00096986-01?
The molecular formula of AB00096986-01 is C24H20N2O5.
What is the molecular weight of AB00096986-01?
The molecular weight of AB00096986-01 is 416.14 g/mol.
Where can I buy AB00096986-01?
You can request a quote for AB00096986-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00096986-01?
Yes, KEHONG BIO provides custom synthesis services for AB00096986-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.