3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea
TL;DR: 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea (CAS 1212423-28-3) is a chemical compound with molecular formula C15H17F3N2O and molecular weight 298.1293 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-bicyclo[2.2.1]heptanyl)-3-[3-(trifluoromethyl)phenyl]urea
Also Known As: 3-{bicyclo[2.2.1]heptan-2-yl}-1-[3-(trifluoromethyl)phenyl]urea, 1-(3-bicyclo[2.2.1]heptanyl)-3-[3-(trifluoromethyl)phenyl]urea, 1-(6-bicyclo[2.2.1]heptyl)-3-[3-(trifluoromethyl)phenyl]urea, 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea, 865-523-6
Technical Specifications
| Molecular Formula | C15H17F3N2O |
| Molecular Weight | 298.1293 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.1293 Da |
| Heavy Atoms | 21 |
| Complexity | 399.0 |
| SMILES | C1CC2CC1CC2NC(=O)NC3=CC=CC(=C3)C(F)(F)F |
| InChIKey | PKPQTBHUGPSIHX-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea
Property Insights of 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea
The XLogP value of 3.6 indicates that 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(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 41.1 Ų, 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(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
What is the CAS number of 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea?
The CAS number of 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea is 1212423-28-3.
What is the molecular formula of 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea?
The molecular formula of 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea is C15H17F3N2O.
What is the molecular weight of 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea?
The molecular weight of 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea is 298.1293 g/mol.
Where can I buy 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea?
You can request a quote for 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea?
Yes, CoreyChem provides custom synthesis services for 3-(Bicyclo(2.2.1)heptan-2-yl)-1-(3-(trifluoromethyl)phenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.