![N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea structure](/static/products/200/200113-23-1.png)
N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea
TL;DR: N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea (CAS 200113-23-1) is a chemical compound with molecular formula C14H12F3N3O and molecular weight 295.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(pyridin-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]urea
Also Known As: N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea, AI-204/31696014, 1-(pyridin-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]urea, 3-(pyridin-4-ylmethyl)-1-[3-(trifluoromethyl)phenyl]urea
| Molecular Formula | C14H12F3N3O |
|---|---|
| Molecular Weight | 295.09 g/mol |
| LogP | 3.4221 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.09326 |
| Heavy Atoms | 21 |
| Complexity | 614.3613 |
Chemical Identifiers
| CAS Number | 200113-23-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)NCC2=CC=NC=C2)C(F)(F)F |
Product Overview
N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea (CAS 200113-23-1), with molecular formula C14H12F3N3O and molecular weight 295.09 g/mol. IUPAC: 1-(pyridin-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]urea.
Chemical Property Profile of N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea
Property Insights of N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea
The XLogP value of 3.4221 indicates that N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.02 Ų, N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea has 2 hydrogen bond donor(s) and 2 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-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea?
The CAS number of N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea is 200113-23-1.
What is the molecular formula of N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea?
The molecular formula of N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea is C14H12F3N3O.
What is the molecular weight of N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea?
The molecular weight of N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea is 295.09 g/mol.
Where can I buy N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea?
You can request a quote for N-(4-pyridinylmethyl)-N'-[3-(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 N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea?
Yes, KEHONG BIO provides custom synthesis services for N-(4-pyridinylmethyl)-N'-[3-(trifluoromethyl)phenyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.