3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione
TL;DR: 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione (CAS 23002-61-1) is a chemical compound with molecular formula C12H11NO3 and molecular weight 217.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethoxy-4-phenylpyrrole-2,5-dione
Also Known As: NCIOpen2_005046, 3-ethoxy-4-phenylpyrrole-2,5-dione, 3-ethoxy-4-phenyl-1h-pyrrole-2,5-dione, 3-Aethoxy-4-phenyl-pyrrol-2,5-dion, 1H-Pyrrole-2,5-dione,3-ethoxy-4-phenyl-
| Molecular Formula | C12H11NO3 |
|---|---|
| Molecular Weight | 217.07 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.0739 |
| Heavy Atoms | 16 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 23002-61-1 |
|---|---|
| SMILES | CCOC1=C(C(=O)NC1=O)C2=CC=CC=C2 |
| InChIKey | OPJZJHGXGWFRPS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione (CAS 23002-61-1), with molecular formula C12H11NO3 and molecular weight 217.07 g/mol. IUPAC: 3-ethoxy-4-phenylpyrrole-2,5-dione.
Chemical Property Profile of 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione
Property Insights of 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione. With a topological polar surface area (TPSA) of 55.4 Ų, 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione has 1 hydrogen bond donor(s) and 3 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-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione?
The CAS number of 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione is 23002-61-1.
What is the molecular formula of 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione?
The molecular formula of 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione is C12H11NO3.
What is the molecular weight of 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione?
The molecular weight of 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione is 217.07 g/mol.
Where can I buy 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione?
You can request a quote for 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethoxy-4-phenyl-1h-pyrrole-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.