4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)-
TL;DR: 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)- (CAS 28617-71-2) is a chemical compound with molecular formula C14H16ClN3OS and molecular weight 309.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-butan-2-yloxy-2-(4-chlorophenyl)sulfanylpyrimidin-4-amine
Also Known As: 6-sec-Butoxy-2-(4-chloro-phenylsulfanyl)-pyrimidin-4-ylamine, J1.320.162E, 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)-, 6-(sec-Butoxy)-2-((4-chlorophenyl)thio)pyrimidin-4-amine, 4-Pyrimidinamine,2-[(4-chlorophenyl)thio]-6-(1-methylpropoxy)-
| Molecular Formula | C14H16ClN3OS |
|---|---|
| Molecular Weight | 309.07 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 86.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 309.07025 |
| Heavy Atoms | 20 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 28617-71-2 |
|---|---|
| SMILES | CCC(C)OC1=NC(=NC(=C1)N)SC2=CC=C(C=C2)Cl |
| InChIKey | WYVNLECNGANDDZ-UHFFFAOYSA-N |
Product Overview
4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)- (CAS 28617-71-2), with molecular formula C14H16ClN3OS and molecular weight 309.07 g/mol. IUPAC: 6-butan-2-yloxy-2-(4-chlorophenyl)sulfanylpyrimidin-4-amine.
Chemical Property Profile of 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)-
Property Insights of 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)-
The XLogP value of 4.5 indicates that 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)-. Following Lipinski's Rule of Five, 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)- 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-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)-?
The CAS number of 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)- is 28617-71-2.
What is the molecular formula of 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)-?
The molecular formula of 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)- is C14H16ClN3OS.
What is the molecular weight of 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)-?
The molecular weight of 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)- is 309.07 g/mol.
Where can I buy 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)-?
You can request a quote for 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)-?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyrimidinamine, 2-((4-chlorophenyl)thio)-6-(1-methylpropoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.