![4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol structure](/static/products/3030/303091-50-1.webp)
4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol
TL;DR: 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol (CAS 303091-50-1) is a chemical compound with molecular formula C11H11BrN2O2 and molecular weight 282.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2-[[(4-methyl-1,2-oxazol-3-yl)amino]methyl]phenol
Also Known As: 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol, 4-bromo-2-{[(4-methylisoxazol-3-yl)amino]methyl}phenol, 4-bromo-2-[[(4-methyl-1,2-oxazol-3-yl)amino]methyl]phenol, 4-BROMO-2-{[(4-METHYL-1,2-OXAZOL-3-YL)AMINO]METHYL}PHENOL
| Molecular Formula | C11H11BrN2O2 |
|---|---|
| Molecular Weight | 282.00 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 58.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.0004 |
| Heavy Atoms | 16 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 303091-50-1 |
|---|---|
| SMILES | CC1=CON=C1NCC2=C(C=CC(=C2)Br)O |
| InChIKey | SRCAKVDADWLQNM-UHFFFAOYSA-N |
Product Overview
4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol (CAS 303091-50-1), with molecular formula C11H11BrN2O2 and molecular weight 282.00 g/mol. IUPAC: 4-bromo-2-[[(4-methyl-1,2-oxazol-3-yl)amino]methyl]phenol.
Chemical Property Profile of 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol
Property Insights of 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol. With a topological polar surface area (TPSA) of 58.3 Ų, 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol has 2 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 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol?
The CAS number of 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol is 303091-50-1.
What is the molecular formula of 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol?
The molecular formula of 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol is C11H11BrN2O2.
What is the molecular weight of 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol?
The molecular weight of 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol is 282.00 g/mol.
Where can I buy 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol?
You can request a quote for 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-[[(4-methyl-3-isoxazolyl)amino]methyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.