1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one
TL;DR: 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one (CAS 7050-43-3) is a chemical compound with molecular formula C30H28N2O8S and molecular weight 576.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(3,4-diethoxyphenyl)-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2H-pyrrol-5-one
Also Known As: 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one, 1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(3,4-diethoxyphenyl)-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2H-pyrrol-5-one
| Molecular Formula | C30H28N2O8S |
|---|---|
| Molecular Weight | 576.16 g/mol |
| LogP | 5.98922 |
| Topological Polar Surface Area | 128.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 576.1566 |
| Heavy Atoms | 41 |
| Complexity | 1716.551 |
Chemical Identifiers
| CAS Number | 7050-43-3 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NC(=C(S3)C(=O)C)C)O)C(=O)C4=CC5=C(O4)C(=CC=C5)OC)OCC |
Product Overview
1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one (CAS 7050-43-3), with molecular formula C30H28N2O8S and molecular weight 576.16 g/mol. IUPAC: 1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(3,4-diethoxyphenyl)-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one
Property Insights of 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one
The XLogP value of 5.98922 indicates that 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one. Following Lipinski's Rule of Five, 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one?
The CAS number of 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one is 7050-43-3.
What is the molecular formula of 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one?
The molecular formula of 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one is C30H28N2O8S.
What is the molecular weight of 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one?
The molecular weight of 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one is 576.16 g/mol.
Where can I buy 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one?
You can request a quote for 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.