AO-022/42100016
TL;DR: AO-022/42100016 (CAS 615271-20-0) is a chemical compound with molecular formula C22H26N2O4S and molecular weight 414.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(dimethylamino)ethyl]-4-hydroxy-2-(4-propan-2-yloxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
Also Known As: AO-022/42100016, 1-[2-(dimethylamino)ethyl]-3-hydroxy-5-(4-isopropoxyphenyl)-4-(2-thienylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one, 1-(2-(dimethylamino)ethyl)-3-hydroxy-5-(4-isopropoxyphenyl)-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one, 1-(2-dimethylaminoethyl)-4-hydroxy-2-(4-propan-2-yloxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one, 1-[2-(dimethylamino)ethyl]-3-hydroxy-5-[4-(methylethoxy)phenyl]-4-(2-thienylca rbonyl)-3-pyrrolin-2-one
| Molecular Formula | C22H26N2O4S |
|---|---|
| Molecular Weight | 414.16 g/mol |
| LogP | 3.6752 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 414.16132 |
| Heavy Atoms | 29 |
| Complexity | 901.4033 |
Chemical Identifiers
| CAS Number | 615271-20-0 |
|---|---|
| SMILES | CC(C)OC1=CC=C(C=C1)C2C(=C(C(=O)N2CCN(C)C)O)C(=O)C3=CC=CS3 |
Product Overview
AO-022/42100016 (CAS 615271-20-0), with molecular formula C22H26N2O4S and molecular weight 414.16 g/mol. IUPAC: 1-[2-(dimethylamino)ethyl]-4-hydroxy-2-(4-propan-2-yloxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of AO-022/42100016
Property Insights of AO-022/42100016
The XLogP value of 3.6752 indicates that AO-022/42100016 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-022/42100016. Following Lipinski's Rule of Five, AO-022/42100016 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 AO-022/42100016?
The CAS number of AO-022/42100016 is 615271-20-0.
What is the molecular formula of AO-022/42100016?
The molecular formula of AO-022/42100016 is C22H26N2O4S.
What is the molecular weight of AO-022/42100016?
The molecular weight of AO-022/42100016 is 414.16 g/mol.
Where can I buy AO-022/42100016?
You can request a quote for AO-022/42100016 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/42100016?
Yes, KEHONG BIO provides custom synthesis services for AO-022/42100016 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.