![Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate structure](/static/products/861/861209-30-5.png)
Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate
TL;DR: Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate (CAS 861209-30-5) is a chemical compound with molecular formula C20H19NO4 and molecular weight 337.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate
Also Known As: Bionet2_001254, methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate, methyl 2-{4-[(E)-3-phenyl-2-propenoyl]-3,4-dihydro-2H-1,4-benzoxazin-3-yl}acetate
| Molecular Formula | C20H19NO4 |
|---|---|
| Molecular Weight | 337.13 g/mol |
| LogP | 3.0571 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 337.1314 |
| Heavy Atoms | 25 |
| Complexity | 785.29297 |
Chemical Identifiers
| CAS Number | 861209-30-5 |
|---|---|
| SMILES | COC(=O)CC1COC2=CC=CC=C2N1C(=O)C=CC3=CC=CC=C3 |
Product Overview
Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate (CAS 861209-30-5), with molecular formula C20H19NO4 and molecular weight 337.13 g/mol. IUPAC: methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate.
Chemical Property Profile of Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate
Property Insights of Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate
The XLogP value of 3.0571 indicates that Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate 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 Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate?
The CAS number of Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate is 861209-30-5.
What is the molecular formula of Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate?
The molecular formula of Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate is C20H19NO4.
What is the molecular weight of Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate?
The molecular weight of Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate is 337.13 g/mol.
Where can I buy Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate?
You can request a quote for Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[4-(3-phenylprop-2-enoyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.