6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one
TL;DR: 6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one (CAS 333307-71-4) 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-(3-methylphenyl)-3,1-benzoxazin-4-one
Also Known As: 6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one, BAS 02101325, BIM-0014635.P001, 6,7-dimethoxy-2-(3-methylphenyl)-3,1-benzoxazin-4-one, 6,7-Dimethoxy-2-(m-tolyl)-4H-benzo[d][1,3]oxazin-4-one
| Molecular Formula | C17H15NO4 |
|---|---|
| Molecular Weight | 297.10 g/mol |
| LogP | 3.18062 |
| Topological Polar Surface Area | 61.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.1001 |
| Heavy Atoms | 22 |
| Complexity | 898.7898 |
Chemical Identifiers
| CAS Number | 333307-71-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=NC3=CC(=C(C=C3C(=O)O2)OC)OC |
Product Overview
6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one (CAS 333307-71-4), with molecular formula C17H15NO4 and molecular weight 297.10 g/mol. IUPAC: 6,7-dimethoxy-2-(3-methylphenyl)-3,1-benzoxazin-4-one.
Chemical Property Profile of 6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one
Property Insights of 6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one
The XLogP value of 3.18062 indicates that 6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one. Following Lipinski's Rule of Five, 6,7-dimethoxy-2-(3-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-(3-methylphenyl)-4H-3,1-benzoxazin-4-one?
The CAS number of 6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one is 333307-71-4.
What is the molecular formula of 6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one?
The molecular formula of 6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one is C17H15NO4.
What is the molecular weight of 6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one?
The molecular weight of 6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one is 297.10 g/mol.
Where can I buy 6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one?
You can request a quote for 6,7-dimethoxy-2-(3-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-(3-methylphenyl)-4H-3,1-benzoxazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6,7-dimethoxy-2-(3-methylphenyl)-4H-3,1-benzoxazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.