1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one
TL;DR: 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one (CAS 587005-32-1) is a chemical compound with molecular formula C22H20N2O4S2 and molecular weight 440.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(4-ethoxyphenyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
Also Known As: 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one, F3226-1184, 1-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(4-ethoxyphenyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one, 1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-2,5-dihydro-1H-pyrrol-2-one, (4E)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-(4-ethoxyphenyl)-4-[hydroxy(thiophen-2-yl)methylidene]pyrrolidine-2,3-dione
| Molecular Formula | C22H20N2O4S2 |
|---|---|
| Molecular Weight | 440.09 g/mol |
| LogP | 5.00304 |
| Topological Polar Surface Area | 79.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 440.08646 |
| Heavy Atoms | 30 |
| Complexity | 1111.1115 |
Chemical Identifiers
| CAS Number | 587005-32-1 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NC(=C(S3)C)C)O)C(=O)C4=CC=CS4 |
Product Overview
1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one (CAS 587005-32-1), with molecular formula C22H20N2O4S2 and molecular weight 440.09 g/mol. IUPAC: 1-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(4-ethoxyphenyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one
Property Insights of 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one
The XLogP value of 5.00304 indicates that 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one. Following Lipinski's Rule of Five, 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one?
The CAS number of 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one is 587005-32-1.
What is the molecular formula of 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one?
The molecular formula of 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one is C22H20N2O4S2.
What is the molecular weight of 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one?
The molecular weight of 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one is 440.09 g/mol.
Where can I buy 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one?
You can request a quote for 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4,5-dimethylthiazol-2-yl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.