5-Methyl-3-phenyl-4-isoxazolamine
TL;DR: 5-Methyl-3-phenyl-4-isoxazolamine (CAS 21169-65-3) is a chemical compound with molecular formula C10H10N2O and molecular weight 174.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3-phenyl-1,2-oxazol-4-amine
Also Known As: 5-METHYL-3-PHENYL-4-ISOXAZOLAMINE, 5-Methyl-3-phenylisoxazol-4-amine, 5-methyl-3-phenyl-1,2-oxazol-4-amine, Maybridge3_007577, 4-Amino-5-methyl-3-phenylisoxazole
| Molecular Formula | C10H10N2O |
|---|---|
| Molecular Weight | 174.08 g/mol |
| LogP | 2.23222 |
| Topological Polar Surface Area | 52.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.07932 |
| Heavy Atoms | 13 |
| Complexity | 406.118 |
Chemical Identifiers
| CAS Number | 21169-65-3 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2)N |
Product Overview
5-Methyl-3-phenyl-4-isoxazolamine (CAS 21169-65-3), with molecular formula C10H10N2O and molecular weight 174.08 g/mol. IUPAC: 5-methyl-3-phenyl-1,2-oxazol-4-amine.
Chemical Property Profile of 5-Methyl-3-phenyl-4-isoxazolamine
Property Insights of 5-Methyl-3-phenyl-4-isoxazolamine
The XLogP value of 2.23222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-3-phenyl-4-isoxazolamine. With a topological polar surface area (TPSA) of 52.05 Ų, 5-Methyl-3-phenyl-4-isoxazolamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-3-phenyl-4-isoxazolamine has 1 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 5-Methyl-3-phenyl-4-isoxazolamine?
The CAS number of 5-Methyl-3-phenyl-4-isoxazolamine is 21169-65-3.
What is the molecular formula of 5-Methyl-3-phenyl-4-isoxazolamine?
The molecular formula of 5-Methyl-3-phenyl-4-isoxazolamine is C10H10N2O.
What is the molecular weight of 5-Methyl-3-phenyl-4-isoxazolamine?
The molecular weight of 5-Methyl-3-phenyl-4-isoxazolamine is 174.08 g/mol.
Where can I buy 5-Methyl-3-phenyl-4-isoxazolamine?
You can request a quote for 5-Methyl-3-phenyl-4-isoxazolamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-3-phenyl-4-isoxazolamine?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-3-phenyl-4-isoxazolamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.