Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate
TL;DR: Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate (CAS 709006-54-2) is a chemical compound with molecular formula C21H16BrNO3 and molecular weight 409.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate
Also Known As: naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate, 2-naphthyl 1-(4-bromophenyl)-5-oxo-3-pyrrolidinecarboxylate
| Molecular Formula | C21H16BrNO3 |
|---|---|
| Molecular Weight | 409.03 g/mol |
| LogP | 4.5608 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 409.03137 |
| Heavy Atoms | 26 |
| Complexity | 983.9726 |
Chemical Identifiers
| CAS Number | 709006-54-2 |
|---|---|
| SMILES | C1C(CN(C1=O)C2=CC=C(C=C2)Br)C(=O)OC3=CC4=CC=CC=C4C=C3 |
Product Overview
Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate (CAS 709006-54-2), with molecular formula C21H16BrNO3 and molecular weight 409.03 g/mol. IUPAC: naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate.
Chemical Property Profile of Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate
Property Insights of Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate
The XLogP value of 4.5608 indicates that Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate has 0 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 Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate?
The CAS number of Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate is 709006-54-2.
What is the molecular formula of Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate?
The molecular formula of Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate is C21H16BrNO3.
What is the molecular weight of Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate?
The molecular weight of Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate is 409.03 g/mol.
Where can I buy Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate?
You can request a quote for Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Naphthalen-2-yl 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.