N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide
TL;DR: N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide (CAS 401631-35-4) is a chemical compound with molecular formula C22H26N4O2 and molecular weight 378.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(cyanomethyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)propanamide
Also Known As: BAS 07119699, N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide, 3-[4-(cyanomethyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)propanamide, N-(4-(benzyloxy)phenyl)-3-(4-(cyanomethyl)piperazin-1-yl)propanamide, N-[4-(benzyloxy)phenyl]-3-[4-(cyanomethyl)piperazin-1-yl]propanamide
| Molecular Formula | C22H26N4O2 |
|---|---|
| Molecular Weight | 378.21 g/mol |
| LogP | 2.73538 |
| Topological Polar Surface Area | 68.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 378.20557 |
| Heavy Atoms | 28 |
| Complexity | 778.4341 |
Chemical Identifiers
| CAS Number | 401631-35-4 |
|---|---|
| SMILES | C1CN(CCN1CCC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3)CC#N |
Product Overview
N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide (CAS 401631-35-4), with molecular formula C22H26N4O2 and molecular weight 378.21 g/mol. IUPAC: 3-[4-(cyanomethyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)propanamide.
Chemical Property Profile of N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide
Property Insights of N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide
The XLogP value of 2.73538 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide. The TPSA of 68.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide. Following Lipinski's Rule of Five, N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide has 1 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 N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide?
The CAS number of N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide is 401631-35-4.
What is the molecular formula of N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide?
The molecular formula of N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide is C22H26N4O2.
What is the molecular weight of N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide?
The molecular weight of N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide is 378.21 g/mol.
Where can I buy N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide?
You can request a quote for N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Benzyloxy-phenyl)-3-(4-cyanomethyl-piperazin-1-yl)-propionamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.