4C-086
TL;DR: 4C-086 (CAS 338417-58-6) is a chemical compound with molecular formula C21H13F3N2O3 and molecular weight 398.08783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-5-oxo-N-[3-(trifluoromethyl)phenyl]chromeno[2,3-b]pyridine-3-carboxamide
Also Known As: 4C-086, 2-methyl-5-oxo-N-[3-(trifluoromethyl)phenyl]-5H-chromeno[2,3-b]pyridine-3-carboxamide, 2-methyl-5-oxo-N-[3-(trifluoromethyl)phenyl]chromeno[2,3-b]pyridine-3-carboxamide
Technical Specifications
| Molecular Formula | C21H13F3N2O3 |
| Molecular Weight | 398.08783 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 68.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 398.08783 Da |
| Heavy Atoms | 29 |
| Complexity | 641.0 |
| SMILES | CC1=C(C=C2C(=O)C3=CC=CC=C3OC2=N1)C(=O)NC4=CC=CC(=C4)C(F)(F)F |
| InChIKey | XNYXSTJUSOSLCZ-UHFFFAOYSA-N |
Chemical Property Profile of 4C-086
Property Insights of 4C-086
The XLogP value of 4.3 indicates that 4C-086 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4C-086. Following Lipinski's Rule of Five, 4C-086 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4C-086?
The CAS number of 4C-086 is 338417-58-6.
What is the molecular formula of 4C-086?
The molecular formula of 4C-086 is C21H13F3N2O3.
What is the molecular weight of 4C-086?
The molecular weight of 4C-086 is 398.08783 g/mol.
Where can I buy 4C-086?
You can request a quote for 4C-086 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4C-086?
Yes, CoreyChem provides custom synthesis services for 4C-086 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.