![4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile structure](/static/products/1189/118943-71-8.webp)
4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile
TL;DR: 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile (CAS 118943-71-8) is a chemical compound with molecular formula C14H18ClN3 and molecular weight 263.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(3-chlorophenyl)piperazin-1-yl]butanenitrile
Also Known As: 4-[4-(3-chlorophenyl)piperazin-1-yl]butanenitrile, 4-[4-(3-chlorophenyl)piperazino]butanenitrile, 4-(4-(3-Chlorophenyl)piperazin-1-yl)butanenitrile
| Molecular Formula | C14H18ClN3 |
|---|---|
| Molecular Weight | 263.12 g/mol |
| LogP | 2.76578 |
| Topological Polar Surface Area | 30.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.11893 |
| Heavy Atoms | 18 |
| Complexity | 419.29245 |
Chemical Identifiers
| CAS Number | 118943-71-8 |
|---|---|
| SMILES | C1CN(CCN1CCCC#N)C2=CC(=CC=C2)Cl |
Product Overview
4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile (CAS 118943-71-8), with molecular formula C14H18ClN3 and molecular weight 263.12 g/mol. IUPAC: 4-[4-(3-chlorophenyl)piperazin-1-yl]butanenitrile.
Chemical Property Profile of 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile
Property Insights of 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile
The XLogP value of 2.76578 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile. With a topological polar surface area (TPSA) of 30.27 Ų, 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile 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 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile?
The CAS number of 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile is 118943-71-8.
What is the molecular formula of 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile?
The molecular formula of 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile is C14H18ClN3.
What is the molecular weight of 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile?
The molecular weight of 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile is 263.12 g/mol.
Where can I buy 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile?
You can request a quote for 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(3-Chlorophenyl)piperazin-1-yl]butanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.