2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate
TL;DR: 2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate (CAS 709010-66-2) is a chemical compound with molecular formula C18H16ClNO3 and molecular weight 329.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chlorophenyl) 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate
Also Known As: 2-chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate, 2-chlorophenyl 5-oxo-1-(p-tolyl)pyrrolidine-3-carboxylate, (2-chlorophenyl) 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate
| Molecular Formula | C18H16ClNO3 |
|---|---|
| Molecular Weight | 329.08 g/mol |
| LogP | 3.60692 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.08188 |
| Heavy Atoms | 23 |
| Complexity | 742.1868 |
Chemical Identifiers
| CAS Number | 709010-66-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OC3=CC=CC=C3Cl |
Product Overview
2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate (CAS 709010-66-2), with molecular formula C18H16ClNO3 and molecular weight 329.08 g/mol. IUPAC: (2-chlorophenyl) 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate.
Chemical Property Profile of 2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate
Property Insights of 2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate
The XLogP value of 3.60692 indicates that 2-Chlorophenyl 1-(4-methylphenyl)-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, 2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chlorophenyl 1-(4-methylphenyl)-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 2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate?
The CAS number of 2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate is 709010-66-2.
What is the molecular formula of 2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate?
The molecular formula of 2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate is C18H16ClNO3.
What is the molecular weight of 2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate?
The molecular weight of 2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate is 329.08 g/mol.
Where can I buy 2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate?
You can request a quote for 2-Chlorophenyl 1-(4-methylphenyl)-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 2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chlorophenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.