2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate
TL;DR: 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate (CAS 1099785-73-5) is a chemical compound with molecular formula C18H22ClNO6 and molecular weight 383.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-O-[2-(4-chlorophenyl)-2-oxoethyl] 1-O-(2-methylpropyl) 4-hydroxypyrrolidine-1,2-dicarboxylate
Also Known As: 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate, 2-[2-(4-chlorophenyl)-2-oxoethyl] 1-(2-methylpropyl) 4-hydroxypyrrolidine-1,2-dicarboxylate, 2-O-[2-(4-chlorophenyl)-2-oxoethyl] 1-O-(2-methylpropyl) 4-hydroxypyrrolidine-1,2-dicarboxylate
| Molecular Formula | C18H22ClNO6 |
|---|---|
| Molecular Weight | 383.11 g/mol |
| LogP | 2.2937 |
| Topological Polar Surface Area | 93.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 383.11356 |
| Heavy Atoms | 26 |
| Complexity | 660.1501 |
Chemical Identifiers
| CAS Number | 1099785-73-5 |
|---|---|
| SMILES | CC(C)COC(=O)N1CC(CC1C(=O)OCC(=O)C2=CC=C(C=C2)Cl)O |
Product Overview
2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate (CAS 1099785-73-5), with molecular formula C18H22ClNO6 and molecular weight 383.11 g/mol. IUPAC: 2-O-[2-(4-chlorophenyl)-2-oxoethyl] 1-O-(2-methylpropyl) 4-hydroxypyrrolidine-1,2-dicarboxylate.
Chemical Property Profile of 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate
Property Insights of 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate
The XLogP value of 2.2937 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate. The TPSA of 93.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate. Following Lipinski's Rule of Five, 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate has 1 hydrogen bond donor(s) and 6 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-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate?
The CAS number of 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate is 1099785-73-5.
What is the molecular formula of 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate?
The molecular formula of 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate is C18H22ClNO6.
What is the molecular weight of 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate?
The molecular weight of 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate is 383.11 g/mol.
Where can I buy 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate?
You can request a quote for 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-(4-chlorophenyl)-2-oxoethyl) 1-isobutyl 4-hydroxypyrrolidine-1,2-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.