3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine
TL;DR: 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine (CAS 52055-71-7) is a chemical compound with molecular formula C17H19NO2 and molecular weight 269.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-3-(2-phenylethyl)-2,4-dihydro-1,3-benzoxazine
Also Known As: NIOSH/DM3078800, 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine, 6-methoxy-3-phenethyl-2,4-dihydro-1,3-benzoxazine, 2H-1,3-Benzoxazine, 3,4-dihydro-6-methoxy-3-(2-phenylethyl)-, 6-methoxy-3-(2-phenylethyl)-2,4-dihydro-1,3-benzoxazine
| Molecular Formula | C17H19NO2 |
|---|---|
| Molecular Weight | 269.14 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.14157 |
| Heavy Atoms | 20 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 52055-71-7 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)OCN(C2)CCC3=CC=CC=C3 |
| InChIKey | QAHQOMLBHCBOAL-UHFFFAOYSA-N |
Product Overview
3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine (CAS 52055-71-7), with molecular formula C17H19NO2 and molecular weight 269.14 g/mol. IUPAC: 6-methoxy-3-(2-phenylethyl)-2,4-dihydro-1,3-benzoxazine.
Chemical Property Profile of 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine
Property Insights of 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine
The XLogP value of 3.5 indicates that 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.7 Ų, 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine has 0 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 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine?
The CAS number of 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine is 52055-71-7.
What is the molecular formula of 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine?
The molecular formula of 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine is C17H19NO2.
What is the molecular weight of 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine?
The molecular weight of 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine is 269.14 g/mol.
Where can I buy 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine?
You can request a quote for 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydro-6-methoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.