4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine
TL;DR: 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine (CAS 264256-44-2) is a chemical compound with molecular formula C13H8Cl2N4O and molecular weight 306.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(2,4-dichlorophenyl)-1,2-oxazol-5-yl]pyrimidin-2-amine
Also Known As: Maybridge1_008670, 4-[3-(2,4-dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine, 4-[3-(2,4-dichlorophenyl)-1,2-oxazol-5-yl]pyrimidin-2-amine, 4-(3-(2,4-Dichlorophenyl)isoxazol-5-yl)pyrimidin-2-amine, 4-[3-(2,4-dichlorophenyl)-5-isoxazolyl]-2-pyrimidinamine
| Molecular Formula | C13H8Cl2N4O |
|---|---|
| Molecular Weight | 306.01 g/mol |
| LogP | 3.6876 |
| Topological Polar Surface Area | 77.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.0075 |
| Heavy Atoms | 20 |
| Complexity | 772.5676 |
Chemical Identifiers
| CAS Number | 264256-44-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)C2=NOC(=C2)C3=NC(=NC=C3)N |
Product Overview
4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine (CAS 264256-44-2), with molecular formula C13H8Cl2N4O and molecular weight 306.01 g/mol. IUPAC: 4-[3-(2,4-dichlorophenyl)-1,2-oxazol-5-yl]pyrimidin-2-amine.
Chemical Property Profile of 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine
Property Insights of 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine
The XLogP value of 3.6876 indicates that 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine. Following Lipinski's Rule of Five, 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine has 1 hydrogen bond donor(s) and 5 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-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine?
The CAS number of 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine is 264256-44-2.
What is the molecular formula of 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine?
The molecular formula of 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine is C13H8Cl2N4O.
What is the molecular weight of 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine?
The molecular weight of 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine is 306.01 g/mol.
Where can I buy 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine?
You can request a quote for 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.