1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile
TL;DR: 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile (CAS 693235-90-4) is a chemical compound with molecular formula C25H22N2O3 and molecular weight 398.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile
Also Known As: ChemDiv3_005980, IDI1_023890, BRD-A98277277-001-01-8, 1-(2-methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile, 2-[4-(benzyloxy)phenyl]-1-(2-methoxyphenyl)-5-oxopyrrolidine-2-carbonitrile
| Molecular Formula | C25H22N2O3 |
|---|---|
| Molecular Weight | 398.16 g/mol |
| LogP | 4.82008 |
| Topological Polar Surface Area | 62.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.16306 |
| Heavy Atoms | 30 |
| Complexity | 1073.5529 |
Chemical Identifiers
| CAS Number | 693235-90-4 |
|---|---|
| SMILES | COC1=CC=CC=C1N2C(=O)CCC2(C#N)C3=CC=C(C=C3)OCC4=CC=CC=C4 |
Product Overview
1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile (CAS 693235-90-4), with molecular formula C25H22N2O3 and molecular weight 398.16 g/mol. IUPAC: 1-(2-methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile.
Chemical Property Profile of 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile
Property Insights of 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile
The XLogP value of 4.82008 indicates that 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile. Following Lipinski's Rule of Five, 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile 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 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile?
The CAS number of 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile is 693235-90-4.
What is the molecular formula of 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile?
The molecular formula of 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile is C25H22N2O3.
What is the molecular weight of 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile?
The molecular weight of 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile is 398.16 g/mol.
Where can I buy 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile?
You can request a quote for 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Methoxyphenyl)-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.