2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol
TL;DR: 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol (CAS 170512-99-9) is a chemical compound with molecular formula C21H21NO5 and molecular weight 367.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazol-5-yl]-5-methoxy-4-propylphenol
Also Known As: 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol, 2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazol-5-yl]-5-methoxy-4-propylphenol, 6-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2H-1,2-oxazol-5-ylidene]-3-methoxy-4-propylcyclohexa-2,4-dien-1-one
| Molecular Formula | C21H21NO5 |
|---|---|
| Molecular Weight | 367.14 g/mol |
| LogP | 4.4465 |
| Topological Polar Surface Area | 73.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 367.14197 |
| Heavy Atoms | 27 |
| Complexity | 963.201 |
Chemical Identifiers
| CAS Number | 170512-99-9 |
|---|---|
| SMILES | CCCC1=CC(=C(C=C1OC)O)C2=C(C=NO2)C3=CC4=C(C=C3)OCCO4 |
Product Overview
2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol (CAS 170512-99-9), with molecular formula C21H21NO5 and molecular weight 367.14 g/mol. IUPAC: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazol-5-yl]-5-methoxy-4-propylphenol.
Chemical Property Profile of 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol
Property Insights of 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol
The XLogP value of 4.4465 indicates that 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.95 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol. Following Lipinski's Rule of Five, 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol has 1 hydrogen bond donor(s) and 6 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-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol?
The CAS number of 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol is 170512-99-9.
What is the molecular formula of 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol?
The molecular formula of 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol is C21H21NO5.
What is the molecular weight of 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol?
The molecular weight of 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol is 367.14 g/mol.
Where can I buy 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol?
You can request a quote for 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-5-yl)-5-methoxy-4-propylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.