AO-022/42016869
TL;DR: AO-022/42016869 (CAS 618366-58-8) is a chemical compound with molecular formula C28H32N2O4 and molecular weight 460.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-benzofuran-2-carbonyl)-1-[2-(diethylamino)ethyl]-4-hydroxy-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one
Also Known As: AO-022/42016869, 4-(1-benzofuran-2-ylcarbonyl)-1-[2-(diethylamino)ethyl]-3-hydroxy-5-(4-isopropylphenyl)-1,5-dihydro-2H-pyrrol-2-one, 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one, 4-(benzo[d]furan-2-ylcarbonyl)-1-[2-(diethylamino)ethyl]-3-hydroxy-5-[4-(methy lethyl)phenyl]-3-pyrrolin-2-one, 4-(benzofuran-2-carbonyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C28H32N2O4 |
|---|---|
| Molecular Weight | 460.24 g/mol |
| LogP | 5.4763 |
| Topological Polar Surface Area | 73.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 460.2362 |
| Heavy Atoms | 34 |
| Complexity | 1185.6918 |
Chemical Identifiers
| CAS Number | 618366-58-8 |
|---|---|
| SMILES | CCN(CC)CCN1C(C(=C(C1=O)O)C(=O)C2=CC3=CC=CC=C3O2)C4=CC=C(C=C4)C(C)C |
Product Overview
AO-022/42016869 (CAS 618366-58-8), with molecular formula C28H32N2O4 and molecular weight 460.24 g/mol. IUPAC: 3-(1-benzofuran-2-carbonyl)-1-[2-(diethylamino)ethyl]-4-hydroxy-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one.
Chemical Property Profile of AO-022/42016869
Property Insights of AO-022/42016869
The XLogP value of 5.4763 indicates that AO-022/42016869 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.99 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/42016869. Following Lipinski's Rule of Five, AO-022/42016869 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AO-022/42016869?
The CAS number of AO-022/42016869 is 618366-58-8.
What is the molecular formula of AO-022/42016869?
The molecular formula of AO-022/42016869 is C28H32N2O4.
What is the molecular weight of AO-022/42016869?
The molecular weight of AO-022/42016869 is 460.24 g/mol.
Where can I buy AO-022/42016869?
You can request a quote for AO-022/42016869 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/42016869?
Yes, KEHONG BIO provides custom synthesis services for AO-022/42016869 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.