3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one
TL;DR: 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one (CAS 384795-83-9) is a chemical compound with molecular formula C21H19N3O3S and molecular weight 393.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy(phenyl)methylidene]-1-(3-imidazol-1-ylpropyl)-5-thiophen-2-ylpyrrolidine-2,3-dione
Also Known As: 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one, (4E)-4-[hydroxy(phenyl)methylidene]-1-(3-imidazol-1-ylpropyl)-5-thiophen-2-ylpyrrolidine-2,3-dione, 1-(3-(1H-imidazol-1-yl)propyl)-4-benzoyl-3-hydroxy-5-(thiophen-2-yl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C21H19N3O3S |
|---|---|
| Molecular Weight | 393.11 g/mol |
| LogP | 3.4566 |
| Topological Polar Surface Area | 75.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 393.11472 |
| Heavy Atoms | 28 |
| Complexity | 994.9723 |
Chemical Identifiers
| CAS Number | 384795-83-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC=CS4)/O |
Product Overview
3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one (CAS 384795-83-9), with molecular formula C21H19N3O3S and molecular weight 393.11 g/mol. IUPAC: (4E)-4-[hydroxy(phenyl)methylidene]-1-(3-imidazol-1-ylpropyl)-5-thiophen-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one
Property Insights of 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one
The XLogP value of 3.4566 indicates that 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one. Following Lipinski's Rule of Five, 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one has 1 hydrogen bond donor(s) and 5 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 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one?
The CAS number of 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one is 384795-83-9.
What is the molecular formula of 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one?
The molecular formula of 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one is C21H19N3O3S.
What is the molecular weight of 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one?
The molecular weight of 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one is 393.11 g/mol.
Where can I buy 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one?
You can request a quote for 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one?
Yes, KEHONG BIO provides custom synthesis services for 3-hydroxy-1-(3-imidazolylpropyl)-4-(phenylcarbonyl)-5-(2-thienyl)-3-pyrrolin-2 -one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.