AO-022/42100087
TL;DR: AO-022/42100087 (CAS 613220-23-8) is a chemical compound with molecular formula C26H32N2O4 and molecular weight 436.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-[2-(diethylamino)ethyl]-4-[hydroxy(phenyl)methylidene]-5-(4-propan-2-yloxyphenyl)pyrrolidine-2,3-dione
Also Known As: AO-022/42100087, (4E)-1-[2-(diethylamino)ethyl]-4-[hydroxy(phenyl)methylidene]-5-(4-propan-2-yloxyphenyl)pyrrolidine-2,3-dione, (E)-[1-[2-(diethylazaniumyl)ethyl]-4,5-dioxo-2-(4-propan-2-yloxyphenyl)pyrrolidin-3-ylidene]-phenylmethanolate, 4-benzoyl-1-[2-(diethylamino)ethyl]-3-hydroxy-5-(4-isopropoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one, 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(4-isopropoxyphenyl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C26H32N2O4 |
|---|---|
| Molecular Weight | 436.24 g/mol |
| LogP | 4.2373 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 436.2362 |
| Heavy Atoms | 32 |
| Complexity | 963.08124 |
Chemical Identifiers
| CAS Number | 613220-23-8 |
|---|---|
| SMILES | CCN(CC)CCN1C(/C(=C(/C2=CC=CC=C2)\O)/C(=O)C1=O)C3=CC=C(C=C3)OC(C)C |
Product Overview
AO-022/42100087 (CAS 613220-23-8), with molecular formula C26H32N2O4 and molecular weight 436.24 g/mol. IUPAC: (4E)-1-[2-(diethylamino)ethyl]-4-[hydroxy(phenyl)methylidene]-5-(4-propan-2-yloxyphenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of AO-022/42100087
Property Insights of AO-022/42100087
The XLogP value of 4.2373 indicates that AO-022/42100087 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.08 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/42100087. Following Lipinski's Rule of Five, AO-022/42100087 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 AO-022/42100087?
The CAS number of AO-022/42100087 is 613220-23-8.
What is the molecular formula of AO-022/42100087?
The molecular formula of AO-022/42100087 is C26H32N2O4.
What is the molecular weight of AO-022/42100087?
The molecular weight of AO-022/42100087 is 436.24 g/mol.
Where can I buy AO-022/42100087?
You can request a quote for AO-022/42100087 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/42100087?
Yes, KEHONG BIO provides custom synthesis services for AO-022/42100087 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.