6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one
TL;DR: 6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one (CAS 140413-19-0) is a chemical compound with molecular formula C14H11N3O4 and molecular weight 285.07495 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-ethyl-7-nitropyrido[2,3-b][1,5]benzoxazepin-5-one
Also Known As: 6Et-7NO2-PBOA-5one, Pyridobenzoxazepinone 63, 6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one, 6-Ethyl-7-nitropyrido[2,3-b][1,5]benzoxazepin-5(6H)-one, 6-ethyl-7-nitro-pyrido[2,3-b][1,5]benzoxazepin-5-one
Technical Specifications
| Molecular Formula | C14H11N3O4 |
| Molecular Weight | 285.07495 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 88.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 285.07495 Da |
| Heavy Atoms | 21 |
| Complexity | 425.0 |
| SMILES | CCN1C2=C(C=CC=C2OC3=C(C1=O)C=CC=N3)[N+](=O)[O-] |
| InChIKey | RUHFIKAUEKLXEQ-UHFFFAOYSA-N |
Chemical Property Profile of 6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one
Property Insights of 6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one. The TPSA of 88.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one. Following Lipinski's Rule of Five, 6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one has 0 hydrogen bond donor(s) and 5 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-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
The CAS number of 6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one is 140413-19-0.
What is the molecular formula of 6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
The molecular formula of 6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one is C14H11N3O4.
What is the molecular weight of 6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
The molecular weight of 6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one is 285.07495 g/mol.
Where can I buy 6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
You can request a quote for 6-Ethyl-7-nitro-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-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one?
Yes, CoreyChem provides custom synthesis services for 6-Ethyl-7-nitro-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.