![2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one structure](/static/products/3498/349-81-5.webp)
2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one
TL;DR: 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one (CAS 349-81-5) is a chemical compound with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5H-pyrido[3,2-b][1,4]oxazepin-4-one
Also Known As: EINECS 252-187-5, 2-methyl-5H-pyrido[3,2-b][1,4]oxazepin-4-one, 2-methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one
| Molecular Formula | C9H8N2O2 |
|---|---|
| Molecular Weight | 176.06 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 176.05858 |
| Heavy Atoms | 13 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 349-81-5 |
|---|---|
| SMILES | CC1=CC(=O)NC2=C(O1)C=CC=N2 |
| InChIKey | ZIAAGDVPXXPXCO-UHFFFAOYSA-N |
Product Overview
2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one (CAS 349-81-5), with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol. IUPAC: 2-methyl-5H-pyrido[3,2-b][1,4]oxazepin-4-one.
Chemical Property Profile of 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one
Property Insights of 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one. With a topological polar surface area (TPSA) of 51.2 Ų, 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-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 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one?
The CAS number of 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one is 349-81-5.
What is the molecular formula of 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one?
The molecular formula of 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one is C9H8N2O2.
What is the molecular weight of 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one?
The molecular weight of 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one is 176.06 g/mol.
Where can I buy 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one?
You can request a quote for 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylpyrido[3,2-b][1,4]oxazepin-4(5h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.