4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate
TL;DR: 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate (CAS 712333-57-8) is a chemical compound with molecular formula C21H21NO5 and molecular weight 367.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methoxycarbonylphenyl) 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate
Also Known As: 4-(methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate, (4-methoxycarbonylphenyl) 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate, 4-(methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxo-3-pyrrolidinecarboxylate
| Molecular Formula | C21H21NO5 |
|---|---|
| Molecular Weight | 367.14 g/mol |
| LogP | 3.04854 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.14197 |
| Heavy Atoms | 27 |
| Complexity | 887.945 |
Chemical Identifiers
| CAS Number | 712333-57-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2CC(CC2=O)C(=O)OC3=CC=C(C=C3)C(=O)OC)C |
Product Overview
4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate (CAS 712333-57-8), with molecular formula C21H21NO5 and molecular weight 367.14 g/mol. IUPAC: (4-methoxycarbonylphenyl) 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate.
Chemical Property Profile of 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate
Property Insights of 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate
The XLogP value of 3.04854 indicates that 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate. Following Lipinski's Rule of Five, 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate has 0 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 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate?
The CAS number of 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate is 712333-57-8.
What is the molecular formula of 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate?
The molecular formula of 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate is C21H21NO5.
What is the molecular weight of 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate?
The molecular weight of 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate is 367.14 g/mol.
Where can I buy 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate?
You can request a quote for 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-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 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-(Methoxycarbonyl)phenyl 1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.