3-(2,5-Difluorophenyl)-1-pentyl-urea
TL;DR: 3-(2,5-Difluorophenyl)-1-pentyl-urea (CAS 4057-41-4) is a chemical compound with molecular formula C12H16F2N2O and molecular weight 242.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,5-difluorophenyl)-3-pentylurea
Also Known As: 3-(2,5-difluorophenyl)-1-pentyl-urea, 1-(2,5-difluorophenyl)-3-pentylurea, N-(2,5-Difluorophenyl)-N'-pentylurea, AB00017689-01
| Molecular Formula | C12H16F2N2O |
|---|---|
| Molecular Weight | 242.12 g/mol |
| LogP | 3.2765 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 242.12306 |
| Heavy Atoms | 17 |
| Complexity | 382.76843 |
Chemical Identifiers
| CAS Number | 4057-41-4 |
|---|---|
| SMILES | CCCCCNC(=O)NC1=C(C=CC(=C1)F)F |
Product Overview
3-(2,5-Difluorophenyl)-1-pentyl-urea (CAS 4057-41-4), with molecular formula C12H16F2N2O and molecular weight 242.12 g/mol. IUPAC: 1-(2,5-difluorophenyl)-3-pentylurea.
Chemical Property Profile of 3-(2,5-Difluorophenyl)-1-pentyl-urea
Property Insights of 3-(2,5-Difluorophenyl)-1-pentyl-urea
The XLogP value of 3.2765 indicates that 3-(2,5-Difluorophenyl)-1-pentyl-urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, 3-(2,5-Difluorophenyl)-1-pentyl-urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,5-Difluorophenyl)-1-pentyl-urea has 2 hydrogen bond donor(s) and 1 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-(2,5-Difluorophenyl)-1-pentyl-urea?
The CAS number of 3-(2,5-Difluorophenyl)-1-pentyl-urea is 4057-41-4.
What is the molecular formula of 3-(2,5-Difluorophenyl)-1-pentyl-urea?
The molecular formula of 3-(2,5-Difluorophenyl)-1-pentyl-urea is C12H16F2N2O.
What is the molecular weight of 3-(2,5-Difluorophenyl)-1-pentyl-urea?
The molecular weight of 3-(2,5-Difluorophenyl)-1-pentyl-urea is 242.12 g/mol.
Where can I buy 3-(2,5-Difluorophenyl)-1-pentyl-urea?
You can request a quote for 3-(2,5-Difluorophenyl)-1-pentyl-urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,5-Difluorophenyl)-1-pentyl-urea?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,5-Difluorophenyl)-1-pentyl-urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.