9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one
TL;DR: 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one (CAS 140413-12-3) is a chemical compound with molecular formula C13H9FN2O2 and molecular weight 244.0648 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9-fluoro-6-methylpyrido[2,3-b][1,5]benzoxazepin-5-one
Also Known As: 9F-6Me-PBOA-5one, 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one, 9-Fluoro-6-methylpyrido[2,3-b][1,5]benzoxazepin-5(6H)-one, 9-fluoro-6-methylpyrido[2,3-b][1,5]benzoxazepin-5-one, Pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one,9-fluoro-6-methyl-
Technical Specifications
| Molecular Formula | C13H9FN2O2 |
| Molecular Weight | 244.0648 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 244.0648 Da |
| Heavy Atoms | 18 |
| Complexity | 339.0 |
| SMILES | CN1C2=C(C=C(C=C2)F)OC3=C(C1=O)C=CC=N3 |
| InChIKey | MOHYLQTWQIHBTI-UHFFFAOYSA-N |
Chemical Property Profile of 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one
Property Insights of 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one. With a topological polar surface area (TPSA) of 42.4 Ų, 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one has 0 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 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
The CAS number of 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one is 140413-12-3.
What is the molecular formula of 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
The molecular formula of 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one is C13H9FN2O2.
What is the molecular weight of 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
The molecular weight of 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one is 244.0648 g/mol.
Where can I buy 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
You can request a quote for 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
Yes, CoreyChem provides custom synthesis services for 9-Fluoro-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.