![3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea structure](/static/products/5141/514199-76-9.webp)
3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea
TL;DR: 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea (CAS 514199-76-9) is a chemical compound with molecular formula C20H23F3N4O2 and molecular weight 408.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea
Also Known As: 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea, N-(3-Methoxyphenyl)-N'-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea, Urea, N-(3-methoxyphenyl)-N'-[2-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)phenyl]-, Urea, N-(3-methoxyphenyl)-Na(2)-[2-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)phenyl]-
| Molecular Formula | C20H23F3N4O2 |
|---|---|
| Molecular Weight | 408.18 g/mol |
| LogP | 4.1098 |
| Topological Polar Surface Area | 56.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 408.1773 |
| Heavy Atoms | 29 |
| Complexity | 865.0451 |
Chemical Identifiers
| CAS Number | 514199-76-9 |
|---|---|
| SMILES | CN1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)NC3=CC(=CC=C3)OC |
Product Overview
3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea (CAS 514199-76-9), with molecular formula C20H23F3N4O2 and molecular weight 408.18 g/mol. IUPAC: 1-(3-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea.
Chemical Property Profile of 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea
Property Insights of 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea
The XLogP value of 4.1098 indicates that 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.84 Ų, 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea has 2 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 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea?
The CAS number of 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea is 514199-76-9.
What is the molecular formula of 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea?
The molecular formula of 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea is C20H23F3N4O2.
What is the molecular weight of 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea?
The molecular weight of 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea is 408.18 g/mol.
Where can I buy 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea?
You can request a quote for 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.