![3-[(5-Bromopyrimidin-2-yl)oxy]aniline structure](/static/products/1119/111987-95-2.webp)
3-[(5-Bromopyrimidin-2-yl)oxy]aniline
TL;DR: 3-[(5-Bromopyrimidin-2-yl)oxy]aniline (CAS 111987-95-2) is a chemical compound with molecular formula C10H8BrN3O and molecular weight 264.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-bromopyrimidin-2-yl)oxyaniline
Also Known As: 3-[(5-Bromopyrimidin-2-yl)oxy]aniline, 3-((5-Bromopyrimidin-2-yl)oxy)aniline, 3-(5-bromopyrimidin-2-yl)oxyaniline, 3-(5-bromopyrimidin-2-yloxy)phenylamine, 3H-Pyrazol-3-one, 2,4-dihydro-5-propyl-2-(2-pyridinyl)-
| Molecular Formula | C10H8BrN3O |
|---|---|
| Molecular Weight | 264.99 g/mol |
| LogP | 2.6136 |
| Topological Polar Surface Area | 61.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.98508 |
| Heavy Atoms | 15 |
| Complexity | 458.4796 |
Chemical Identifiers
| CAS Number | 111987-95-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC2=NC=C(C=N2)Br)N |
Product Overview
3-[(5-Bromopyrimidin-2-yl)oxy]aniline (CAS 111987-95-2), with molecular formula C10H8BrN3O and molecular weight 264.99 g/mol. IUPAC: 3-(5-bromopyrimidin-2-yl)oxyaniline.
Chemical Property Profile of 3-[(5-Bromopyrimidin-2-yl)oxy]aniline
Property Insights of 3-[(5-Bromopyrimidin-2-yl)oxy]aniline
The XLogP value of 2.6136 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(5-Bromopyrimidin-2-yl)oxy]aniline. The TPSA of 61.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(5-Bromopyrimidin-2-yl)oxy]aniline. Following Lipinski's Rule of Five, 3-[(5-Bromopyrimidin-2-yl)oxy]aniline has 1 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 3-[(5-Bromopyrimidin-2-yl)oxy]aniline?
The CAS number of 3-[(5-Bromopyrimidin-2-yl)oxy]aniline is 111987-95-2.
What is the molecular formula of 3-[(5-Bromopyrimidin-2-yl)oxy]aniline?
The molecular formula of 3-[(5-Bromopyrimidin-2-yl)oxy]aniline is C10H8BrN3O.
What is the molecular weight of 3-[(5-Bromopyrimidin-2-yl)oxy]aniline?
The molecular weight of 3-[(5-Bromopyrimidin-2-yl)oxy]aniline is 264.99 g/mol.
Where can I buy 3-[(5-Bromopyrimidin-2-yl)oxy]aniline?
You can request a quote for 3-[(5-Bromopyrimidin-2-yl)oxy]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(5-Bromopyrimidin-2-yl)oxy]aniline?
Yes, KEHONG BIO provides custom synthesis services for 3-[(5-Bromopyrimidin-2-yl)oxy]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.