N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea
TL;DR: N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea (CAS 866008-67-5) is a chemical compound with molecular formula C15H17FN2O and molecular weight 260.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-ethynylcyclohexyl)-3-(4-fluorophenyl)urea
Also Known As: N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea, 3-(1-ethynylcyclohexyl)-1-(4-fluorophenyl)urea, 1-(1-ethynylcyclohexyl)-3-(4-fluorophenyl)urea
| Molecular Formula | C15H17FN2O |
|---|---|
| Molecular Weight | 260.13 g/mol |
| LogP | 3.2833 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.13248 |
| Heavy Atoms | 19 |
| Complexity | 483.86218 |
Chemical Identifiers
| CAS Number | 866008-67-5 |
|---|---|
| SMILES | C#CC1(CCCCC1)NC(=O)NC2=CC=C(C=C2)F |
Product Overview
N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea (CAS 866008-67-5), with molecular formula C15H17FN2O and molecular weight 260.13 g/mol. IUPAC: 1-(1-ethynylcyclohexyl)-3-(4-fluorophenyl)urea.
Chemical Property Profile of N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea
Property Insights of N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea
The XLogP value of 3.2833 indicates that N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)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, N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)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 N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea?
The CAS number of N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea is 866008-67-5.
What is the molecular formula of N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea?
The molecular formula of N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea is C15H17FN2O.
What is the molecular weight of N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea?
The molecular weight of N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea is 260.13 g/mol.
Where can I buy N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea?
You can request a quote for N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-(1-ethynylcyclohexyl)-N'-(4-fluorophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.