1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile
TL;DR: 1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile (CAS 664972-10-5) is a chemical compound with molecular formula C25H22N2O2 and molecular weight 382.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile
Also Known As: 1-benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile, 1-benzyl-2-[4-(benzyloxy)phenyl]-5-oxo-2-pyrrolidinecarbonitrile, AJ-292/42152678, 1-benzyl-2-(4-(benzyloxy)phenyl)-5-oxopyrrolidine-2-carbonitrile, 1-benzyl-2-(4-benzyloxyphenyl)-5-oxo-pyrrolidine-2-carbonitrile
| Molecular Formula | C25H22N2O2 |
|---|---|
| Molecular Weight | 382.17 g/mol |
| LogP | 4.80708 |
| Topological Polar Surface Area | 53.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.16812 |
| Heavy Atoms | 29 |
| Complexity | 1010.1988 |
Chemical Identifiers
| CAS Number | 664972-10-5 |
|---|---|
| SMILES | C1CC(N(C1=O)CC2=CC=CC=C2)(C#N)C3=CC=C(C=C3)OCC4=CC=CC=C4 |
Product Overview
1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile (CAS 664972-10-5), with molecular formula C25H22N2O2 and molecular weight 382.17 g/mol. IUPAC: 1-benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile.
Chemical Property Profile of 1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile
Property Insights of 1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile
The XLogP value of 4.80708 indicates that 1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.33 Ų, 1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile 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 1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile?
The CAS number of 1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile is 664972-10-5.
What is the molecular formula of 1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile?
The molecular formula of 1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile is C25H22N2O2.
What is the molecular weight of 1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile?
The molecular weight of 1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile is 382.17 g/mol.
Where can I buy 1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile?
You can request a quote for 1-Benzyl-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-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-5-oxo-2-(4-phenylmethoxyphenyl)pyrrolidine-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.