1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
TL;DR: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one (CAS 517870-69-8) is a chemical compound with molecular formula C26H25NO6S and molecular weight 479.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
Also Known As: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
| Molecular Formula | C26H25NO6S |
|---|---|
| Molecular Weight | 479.14 g/mol |
| LogP | 4.5949 |
| Topological Polar Surface Area | 85.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 479.14026 |
| Heavy Atoms | 34 |
| Complexity | 1233.8477 |
Chemical Identifiers
| CAS Number | 517870-69-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC=CC=C4OC)OC |
Product Overview
1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one (CAS 517870-69-8), with molecular formula C26H25NO6S and molecular weight 479.14 g/mol. IUPAC: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
Property Insights of 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
The XLogP value of 4.5949 indicates that 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one. Following Lipinski's Rule of Five, 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one 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 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one?
The CAS number of 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one is 517870-69-8.
What is the molecular formula of 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one?
The molecular formula of 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one is C26H25NO6S.
What is the molecular weight of 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one?
The molecular weight of 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one is 479.14 g/mol.
Where can I buy 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one?
You can request a quote for 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.