3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide
TL;DR: 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide (CAS 725696-85-5) is a chemical compound with molecular formula C16H18ClFN2O2 and molecular weight 324.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-1,2-oxazole-5-carboxamide
Also Known As: BAS 09528697, AB01284831-01, AN-329/43210764, 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide, 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-1,2-oxazole-5-carboxamide
| Molecular Formula | C16H18ClFN2O2 |
|---|---|
| Molecular Weight | 324.10 g/mol |
| LogP | 3.421 |
| Topological Polar Surface Area | 50.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.1041 |
| Heavy Atoms | 22 |
| Complexity | 579.55865 |
Chemical Identifiers
| CAS Number | 725696-85-5 |
|---|---|
| SMILES | C1CCC(CC1)NC(=O)C2CC(=NO2)C3=C(C=CC=C3Cl)F |
Product Overview
3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide (CAS 725696-85-5), with molecular formula C16H18ClFN2O2 and molecular weight 324.10 g/mol. IUPAC: 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-1,2-oxazole-5-carboxamide.
Chemical Property Profile of 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide
Property Insights of 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide
The XLogP value of 3.421 indicates that 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.69 Ų, 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide has 1 hydrogen bond donor(s) and 3 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-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide?
The CAS number of 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide is 725696-85-5.
What is the molecular formula of 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide?
The molecular formula of 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide is C16H18ClFN2O2.
What is the molecular weight of 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide?
The molecular weight of 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide is 324.10 g/mol.
Where can I buy 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide?
You can request a quote for 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-chloro-6-fluorophenyl)-N-cyclohexyl-4,5-dihydro-5-isoxazolecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.