![2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one structure](/static/products/313/313231-05-9.png)
2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one
TL;DR: 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one (CAS 313231-05-9) is a chemical compound with molecular formula C17H13NO3 and molecular weight 279.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one
Also Known As: 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one, 2-[2-(2-methoxyphenyl)vinyl]-4H-3,1-benzoxazin-4-one, 2-[(1E)-2-(2-methoxyphenyl)vinyl]benzo[d]1,3-oxazin-4-one, 2-[(E)-2-(2-methoxyphenyl)ethenyl]-4H-3,1-benzoxazin-4-one, 2-[(E)-2-(2-methoxyphenyl)vinyl]-4H-3,1-benzoxazin-4-one
| Molecular Formula | C17H13NO3 |
|---|---|
| Molecular Weight | 279.09 g/mol |
| LogP | 3.367 |
| Topological Polar Surface Area | 52.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.08954 |
| Heavy Atoms | 21 |
| Complexity | 865.03827 |
Chemical Identifiers
| CAS Number | 313231-05-9 |
|---|---|
| SMILES | COC1=CC=CC=C1/C=C/C2=NC3=CC=CC=C3C(=O)O2 |
Product Overview
2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one (CAS 313231-05-9), with molecular formula C17H13NO3 and molecular weight 279.09 g/mol. IUPAC: 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one.
Chemical Property Profile of 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one
Property Insights of 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one
The XLogP value of 3.367 indicates that 2-[(E)-2-(2-methoxyphenyl)ethenyl]-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 52.33 Ų, 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one has 0 hydrogen bond donor(s) and 4 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-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one?
The CAS number of 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one is 313231-05-9.
What is the molecular formula of 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one?
The molecular formula of 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one is C17H13NO3.
What is the molecular weight of 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one?
The molecular weight of 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one is 279.09 g/mol.
Where can I buy 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one?
You can request a quote for 2-[(E)-2-(2-methoxyphenyl)ethenyl]-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 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[(E)-2-(2-methoxyphenyl)ethenyl]-3,1-benzoxazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.