AO-022/42100665
TL;DR: AO-022/42100665 (CAS 615276-36-3) is a chemical compound with molecular formula C24H28N2O5S and molecular weight 456.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy-(4-propoxyphenyl)methylidene]-1-(2-morpholin-4-ylethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione
Also Known As: AO-022/42100665, (4E)-4-[hydroxy-(4-propoxyphenyl)methylidene]-1-(2-morpholin-4-ylethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione, (E)-[1-(2-morpholin-4-ium-4-ylethyl)-4,5-dioxo-2-thiophen-2-ylpyrrolidin-3-ylidene]-(4-propoxyphenyl)methanolate, 3-hydroxy-1-[2-(4-morpholinyl)ethyl]-4-(4-propoxybenzoyl)-5-(2-thienyl)-1,5-dihydro-2H-pyrrol-2-one, (4Z)-4-[hydroxy-(4-propoxyphenyl)methylidene]-1-(2-morpholin-4-ylethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione
| Molecular Formula | C24H28N2O5S |
|---|---|
| Molecular Weight | 456.17 g/mol |
| LogP | 3.2908 |
| Topological Polar Surface Area | 79.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 456.1719 |
| Heavy Atoms | 32 |
| Complexity | 964.7856 |
Chemical Identifiers
| CAS Number | 615276-36-3 |
|---|---|
| SMILES | CCCOC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCN3CCOCC3)C4=CC=CS4)/O |
Product Overview
AO-022/42100665 (CAS 615276-36-3), with molecular formula C24H28N2O5S and molecular weight 456.17 g/mol. IUPAC: (4E)-4-[hydroxy-(4-propoxyphenyl)methylidene]-1-(2-morpholin-4-ylethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of AO-022/42100665
Property Insights of AO-022/42100665
The XLogP value of 3.2908 indicates that AO-022/42100665 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.31 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/42100665. Following Lipinski's Rule of Five, AO-022/42100665 has 1 hydrogen bond donor(s) and 7 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-022/42100665?
The CAS number of AO-022/42100665 is 615276-36-3.
What is the molecular formula of AO-022/42100665?
The molecular formula of AO-022/42100665 is C24H28N2O5S.
What is the molecular weight of AO-022/42100665?
The molecular weight of AO-022/42100665 is 456.17 g/mol.
Where can I buy AO-022/42100665?
You can request a quote for AO-022/42100665 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/42100665?
Yes, KEHONG BIO provides custom synthesis services for AO-022/42100665 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.