N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide
TL;DR: N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide (CAS 701941-58-4) is a chemical compound with molecular formula C22H26N2O2S and molecular weight 382.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide
Also Known As: N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide, N-benzyl-2-{4-[(4-methylpiperidin-1-yl)carbonothioyl]phenoxy}acetamide
| Molecular Formula | C22H26N2O2S |
|---|---|
| Molecular Weight | 382.17 g/mol |
| LogP | 3.7892 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.1715 |
| Heavy Atoms | 27 |
| Complexity | 753.6421 |
Chemical Identifiers
| CAS Number | 701941-58-4 |
|---|---|
| SMILES | CC1CCN(CC1)C(=S)C2=CC=C(C=C2)OCC(=O)NCC3=CC=CC=C3 |
Product Overview
N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide (CAS 701941-58-4), with molecular formula C22H26N2O2S and molecular weight 382.17 g/mol. IUPAC: N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide.
Chemical Property Profile of N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide
Property Insights of N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide
The XLogP value of 3.7892 indicates that N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.57 Ų, N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide has 1 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 N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide?
The CAS number of N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide is 701941-58-4.
What is the molecular formula of N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide?
The molecular formula of N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide is C22H26N2O2S.
What is the molecular weight of N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide?
The molecular weight of N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide is 382.17 g/mol.
Where can I buy N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide?
You can request a quote for N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-2-[4-(4-methylpiperidine-1-carbothioyl)phenoxy]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.