5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole
TL;DR: 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole (CAS 501902-28-9) is a chemical compound with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4,5-trimethoxyphenyl)-1,2-oxazol-5-amine
Also Known As: 3-(3,4,5-trimethoxyphenyl)-1,2-oxazol-5-amine, 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole, 3-(3,4,5-Trimethoxyphenyl)isoxazol-5-amine, N/A
| Molecular Formula | C12H14N2O4 |
|---|---|
| Molecular Weight | 250.10 g/mol |
| LogP | 1.9496 |
| Topological Polar Surface Area | 79.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 250.09535 |
| Heavy Atoms | 18 |
| Complexity | 525.7556 |
Chemical Identifiers
| CAS Number | 501902-28-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C2=NOC(=C2)N |
Product Overview
5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole (CAS 501902-28-9), with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol. IUPAC: 3-(3,4,5-trimethoxyphenyl)-1,2-oxazol-5-amine.
Chemical Property Profile of 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole
Property Insights of 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole
The XLogP value of 1.9496 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole. The TPSA of 79.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole. Following Lipinski's Rule of Five, 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole 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 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole?
The CAS number of 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole is 501902-28-9.
What is the molecular formula of 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole?
The molecular formula of 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole is C12H14N2O4.
What is the molecular weight of 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole?
The molecular weight of 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole is 250.10 g/mol.
Where can I buy 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole?
You can request a quote for 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-3-(3,4,5-trimethoxyphenyl)isoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.