来氟米特
TL;DR: 来氟米特 (CAS 75706-12-6) is a chemical compound with molecular formula C12H9F3N2O2 and molecular weight 270.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
来氟米特
5-methyl-N-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide
Also Known As: leflunomide, Arava, Leflunomida, Leflunomidum, lefunamide
| Molecular Formula | C12H9F3N2O2 |
|---|---|
| Molecular Weight | 270.06 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.0616 |
| Heavy Atoms | 19 |
| Complexity | 327.0 |
| Melting Point | 165-166 °C |
| Solubility | 21 |
| Vapor Pressure | 1.25X10-6 mm Hg at 25 °C /Estimated/ |
Chemical Identifiers
| CAS Number | 75706-12-6 |
|---|---|
| SMILES | CC1=C(C=NO1)C(=O)NC2=CC=C(C=C2)C(F)(F)F |
| InChIKey | VHOGYURTWQBHIL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
来氟米特 (CAS 75706-12-6), with molecular formula C12H9F3N2O2 and molecular weight 270.06 g/mol. IUPAC: 5-methyl-N-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide.
Chemical Property Profile of 来氟米特
Property Insights of 来氟米特
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 来氟米特. With a topological polar surface area (TPSA) of 55.1 Ų, 来氟米特 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 來氟米特 has 1 hydrogen bond donor(s) and 6 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 來氟米特?
The CAS number of 來氟米特 is 75706-12-6.
What is the molecular formula of 來氟米特?
The molecular formula of 來氟米特 is C12H9F3N2O2.
What is the molecular weight of 來氟米特?
The molecular weight of 來氟米特 is 270.06 g/mol.
Where can I buy 來氟米特?
You can request a quote for 來氟米特 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 來氟米特?
Yes, KEHONG BIO provides custom synthesis services for 來氟米特 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.