2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate
TL;DR: 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate (CAS 299969-20-3) is a chemical compound with molecular formula C17H13NO4 and molecular weight 295.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dioxopyrrolidin-1-yl) 4-phenylbenzoate
Also Known As: 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate, (2,5-dioxopyrrolidin-1-yl) 4-phenylbenzoate, 2,5-dioxoazolidinyl 4-phenylbenzoate, BAS 00065749, 2,5-Dioxo-1-pyrrolidinyl Biphenyl-4-carboxylate
| Molecular Formula | C17H13NO4 |
|---|---|
| Molecular Weight | 295.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 63.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.08447 |
| Heavy Atoms | 22 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 299969-20-3 |
|---|---|
| SMILES | C1CC(=O)N(C1=O)OC(=O)C2=CC=C(C=C2)C3=CC=CC=C3 |
| InChIKey | WPFNLWKQMSNEHE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate (CAS 299969-20-3), with molecular formula C17H13NO4 and molecular weight 295.08 g/mol. IUPAC: (2,5-dioxopyrrolidin-1-yl) 4-phenylbenzoate.
Chemical Property Profile of 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate
Property Insights of 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate. Following Lipinski's Rule of Five, 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate has 0 hydrogen bond donor(s) and 4 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 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate?
The CAS number of 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate is 299969-20-3.
What is the molecular formula of 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate?
The molecular formula of 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate is C17H13NO4.
What is the molecular weight of 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate?
The molecular weight of 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate is 295.08 g/mol.
Where can I buy 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate?
You can request a quote for 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dioxopyrrolidin-1-yl [1,1'-biphenyl]-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.