6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one
TL;DR: 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one (CAS 134894-50-1) is a chemical compound with molecular formula C14H12N2O2 and molecular weight 240.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-ethylpyrido[2,3-b][1,5]benzoxazepin-5-one
Also Known As: 6Et-PBOA-5one, 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one, 6-ethylpyrido[2,3-b][1,5]benzoxazepin-5-one, 6-Ethylpyrido[2,3-b][1,5]benzoxazepin-5(6H)-one, 6-Ethyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H12N2O2 |
| Molecular Weight | 240.08987 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 240.08987 Da |
| Heavy Atoms | 18 |
| Complexity | 321.0 |
| SMILES | CCN1C2=CC=CC=C2OC3=C(C1=O)C=CC=N3 |
| InChIKey | FEDMVRUBHRFKGY-UHFFFAOYSA-N |
Chemical Property Profile of 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one
Property Insights of 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one. With a topological polar surface area (TPSA) of 42.4 Ų, 6-Ethyl-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, 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
The CAS number of 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one is 134894-50-1.
What is the molecular formula of 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
The molecular formula of 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one is C14H12N2O2.
What is the molecular weight of 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
The molecular weight of 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one is 240.08987 g/mol.
Where can I buy 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
You can request a quote for 6-Ethyl-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 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
Yes, CoreyChem provides custom synthesis services for 6-Ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.