![2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide structure](/static/products/4000/400076-89-3.webp)
2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide
TL;DR: 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide (CAS 400076-89-3) is a chemical compound with molecular formula C13H16Cl3N3O and molecular weight 335.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide
Also Known As: 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide, 12G-335S, 2,2,2-trichloro-N-[2-(4-methylpiperazino)phenyl]acetamide
| Molecular Formula | C13H16Cl3N3O |
|---|---|
| Molecular Weight | 335.04 g/mol |
| LogP | 2.7471 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 335.0359 |
| Heavy Atoms | 20 |
| Complexity | 481.99487 |
Chemical Identifiers
| CAS Number | 400076-89-3 |
|---|---|
| SMILES | CN1CCN(CC1)C2=CC=CC=C2NC(=O)C(Cl)(Cl)Cl |
Product Overview
2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide (CAS 400076-89-3), with molecular formula C13H16Cl3N3O and molecular weight 335.04 g/mol. IUPAC: 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide.
Chemical Property Profile of 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide
Property Insights of 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide
The XLogP value of 2.7471 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide. With a topological polar surface area (TPSA) of 35.58 Ų, 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]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 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide?
The CAS number of 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide is 400076-89-3.
What is the molecular formula of 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide?
The molecular formula of 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide is C13H16Cl3N3O.
What is the molecular weight of 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide?
The molecular weight of 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide is 335.04 g/mol.
Where can I buy 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide?
You can request a quote for 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2-trichloro-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.