7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole
TL;DR: 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole (CAS 57595-85-4) is a chemical compound with molecular formula C17H15NO3 and molecular weight 281.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,8-dimethoxy-10,11-dihydronaphtho[1,2-g][1,2]benzoxazole
Also Known As: 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole, 7,8-dimethoxy-10,11-dihydronaphtho[1,2-g][1,2]benzoxazole, 10,8-DIMETHOXYPHENANTHRO[2,1-D]ISOXAZOLE, 1-Phenyl-4,5-dihydro-7,8-dihydroxy-1H-benz
| Molecular Formula | C17H15NO3 |
|---|---|
| Molecular Weight | 281.11 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 44.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.1052 |
| Heavy Atoms | 21 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 57595-85-4 |
|---|---|
| SMILES | COC1=C(C=C2C3=C(C=CC2=C1)C4=C(CC3)C=NO4)OC |
| InChIKey | SGHKGRHEEDBJDL-UHFFFAOYSA-N |
Product Overview
7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole (CAS 57595-85-4), with molecular formula C17H15NO3 and molecular weight 281.11 g/mol. IUPAC: 7,8-dimethoxy-10,11-dihydronaphtho[1,2-g][1,2]benzoxazole.
Chemical Property Profile of 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole
Property Insights of 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole
The XLogP value of 3.5 indicates that 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.5 Ų, 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole 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 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole?
The CAS number of 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole is 57595-85-4.
What is the molecular formula of 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole?
The molecular formula of 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole is C17H15NO3.
What is the molecular weight of 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole?
The molecular weight of 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole is 281.11 g/mol.
Where can I buy 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole?
You can request a quote for 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole?
Yes, KEHONG BIO provides custom synthesis services for 7,8-Dimethoxy-10,11-dihydrophenanthro(2,1-d)isoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.