2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide
TL;DR: 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide (CAS 895945-96-7) is a chemical compound with molecular formula C15H22ClN3O2 and molecular weight 311.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide
Also Known As: 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide, 2-(3-chlorophenoxy)-N-(4-methylpiperazinyl)butanamide
| Molecular Formula | C15H22ClN3O2 |
|---|---|
| Molecular Weight | 311.14 g/mol |
| LogP | 1.776 |
| Topological Polar Surface Area | 44.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 311.14005 |
| Heavy Atoms | 21 |
| Complexity | 475.74146 |
Chemical Identifiers
| CAS Number | 895945-96-7 |
|---|---|
| SMILES | CCC(C(=O)NN1CCN(CC1)C)OC2=CC(=CC=C2)Cl |
Product Overview
2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide (CAS 895945-96-7), with molecular formula C15H22ClN3O2 and molecular weight 311.14 g/mol. IUPAC: 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide.
Chemical Property Profile of 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide
Property Insights of 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide
The XLogP value of 1.776 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide. With a topological polar surface area (TPSA) of 44.81 Ų, 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide has 1 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 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide?
The CAS number of 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide is 895945-96-7.
What is the molecular formula of 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide?
The molecular formula of 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide is C15H22ClN3O2.
What is the molecular weight of 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide?
The molecular weight of 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide is 311.14 g/mol.
Where can I buy 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide?
You can request a quote for 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-chlorophenoxy)-N-(4-methylpiperazin-1-yl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.