2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole
TL;DR: 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole (CAS 6957-21-7) is a chemical compound with molecular formula C19H15NO3 and molecular weight 305.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)benzo[e][1,3]benzoxazole
Also Known As: 2-(3,4-dimethoxyphenyl)benzo[e][1,3]benzoxazole, 2-(3,4-dimethoxyphenyl)naphtho[1,2-d][1,3]oxazole
| Molecular Formula | C19H15NO3 |
|---|---|
| Molecular Weight | 305.11 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 44.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.1052 |
| Heavy Atoms | 23 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 6957-21-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC4=CC=CC=C43)OC |
| InChIKey | OQCLFYAMGYCFGL-UHFFFAOYSA-N |
Product Overview
2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole (CAS 6957-21-7), with molecular formula C19H15NO3 and molecular weight 305.11 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)benzo[e][1,3]benzoxazole.
Chemical Property Profile of 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole
Property Insights of 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole
The XLogP value of 4.6 indicates that 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.5 Ų, 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole 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-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole?
The CAS number of 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole is 6957-21-7.
What is the molecular formula of 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole?
The molecular formula of 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole is C19H15NO3.
What is the molecular weight of 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole?
The molecular weight of 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole is 305.11 g/mol.
Where can I buy 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole?
You can request a quote for 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethoxyphenyl)benzo[e][1,3]benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.