![9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one structure](/static/products/1404/140413-11-2.webp)
9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one
TL;DR: 9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one (CAS 140413-11-2) is a chemical compound with molecular formula C13H10N2O2 and molecular weight 226.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-methyl-6H-pyrido[2,3-b][1,5]benzoxazepin-5-one
Also Known As: 9Me-PBOA-5one, 9-methyl-6H-pyrido[2,3-b][1,5]benzoxazepin-5-one, 9-methylpyrido[2,3-b][1,5]benzoxazepin-5(6H)-one, 9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one, 9-Methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one
| Molecular Formula | C13H10N2O2 |
|---|---|
| Molecular Weight | 226.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 226.07423 |
| Heavy Atoms | 17 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 140413-11-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(=O)C3=C(O2)N=CC=C3 |
| InChIKey | LIBUCSSGWQGTRG-UHFFFAOYSA-N |
Product Overview
9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one (CAS 140413-11-2), with molecular formula C13H10N2O2 and molecular weight 226.07 g/mol. IUPAC: 9-methyl-6H-pyrido[2,3-b][1,5]benzoxazepin-5-one.
Chemical Property Profile of 9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one
Property Insights of 9-Methyl-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 9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one. With a topological polar surface area (TPSA) of 51.2 Ų, 9-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-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one has 1 hydrogen bond donor(s) and 3 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 9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one?
The CAS number of 9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one is 140413-11-2.
What is the molecular formula of 9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one?
The molecular formula of 9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one is C13H10N2O2.
What is the molecular weight of 9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one?
The molecular weight of 9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one is 226.07 g/mol.
Where can I buy 9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one?
You can request a quote for 9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Methyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one?
Yes, KEHONG BIO provides custom synthesis services for 9-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.