6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one
TL;DR: 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one (CAS 333343-05-8) is a chemical compound with molecular formula C17H15NO4 and molecular weight 297.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dimethoxy-2-(2-methylphenyl)-3,1-benzoxazin-4-one
Also Known As: 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one, BAS 00762599, 6,7-dimethoxy-2-(2-methylphenyl)-3,1-benzoxazin-4-one, 6,7-Dimethoxy-2-(o-tolyl)-4h-benzo[d][1,3]oxazin-4-one, 6,7-Dimethoxy-2-o-tolyl-benzo[d][1,3]oxazin-4-one
| Molecular Formula | C17H15NO4 |
|---|---|
| Molecular Weight | 297.10 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 57.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.1001 |
| Heavy Atoms | 22 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 333343-05-8 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=NC3=CC(=C(C=C3C(=O)O2)OC)OC |
| InChIKey | OYVGERUZAUOBSX-UHFFFAOYSA-N |
Product Overview
6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one (CAS 333343-05-8), with molecular formula C17H15NO4 and molecular weight 297.10 g/mol. IUPAC: 6,7-dimethoxy-2-(2-methylphenyl)-3,1-benzoxazin-4-one.
Chemical Property Profile of 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one
Property Insights of 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one
The XLogP value of 3.2 indicates that 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.1 Ų, 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-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
Frequently Asked Questions
What is the CAS number of 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one?
The CAS number of 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one is 333343-05-8.
What is the molecular formula of 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one?
The molecular formula of 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one is C17H15NO4.
What is the molecular weight of 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one?
The molecular weight of 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one is 297.10 g/mol.
Where can I buy 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one?
You can request a quote for 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6,7-dimethoxy-2-(2-methylphenyl)-4H-3,1-benzoxazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.