2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)-
TL;DR: 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)- (CAS 59004-54-5) is a chemical compound with molecular formula C22H21NO2 and molecular weight 331.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-phenoxy-3-(2-phenylethyl)-2,4-dihydro-1,3-benzoxazine
Also Known As: 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)-, 8-Phenoxy-3-(2-phenylethyl)-3,4-dihydro-2H-1,3-benzoxazine, 3,4-Dihydro-8-phenoxy-3-(2-phenylethyl)-2H-1,3-benzoxazine, 3-phenethyl-8-phenoxy-2,4-dihydro-1,3-benzoxazine, RefChem:267786
| Molecular Formula | C22H21NO2 |
|---|---|
| Molecular Weight | 331.16 g/mol |
| LogP | 4.8735 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.15723 |
| Heavy Atoms | 25 |
| Complexity | 817.9456 |
Chemical Identifiers
| CAS Number | 59004-54-5 |
|---|---|
| SMILES | C1C2=C(C(=CC=C2)OC3=CC=CC=C3)OCN1CCC4=CC=CC=C4 |
Product Overview
2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)- (CAS 59004-54-5), with molecular formula C22H21NO2 and molecular weight 331.16 g/mol. IUPAC: 8-phenoxy-3-(2-phenylethyl)-2,4-dihydro-1,3-benzoxazine.
Chemical Property Profile of 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)-
Property Insights of 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)-
The XLogP value of 4.8735 indicates that 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.7 Ų, 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)- 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 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)-?
The CAS number of 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)- is 59004-54-5.
What is the molecular formula of 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)-?
The molecular formula of 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)- is C22H21NO2.
What is the molecular weight of 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)-?
The molecular weight of 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)- is 331.16 g/mol.
Where can I buy 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)-?
You can request a quote for 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,3-Benzoxazine, 3,4-dihydro-8-phenoxy-3-(2-phenylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.