6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine
TL;DR: 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine (CAS 500896-56-0) is a chemical compound with molecular formula C5H5ClIN3S and molecular weight 300.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-5-iodo-2-methylsulfanylpyrimidin-4-amine
Also Known As: 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine, 4-amino-6-chloro-5-iodo-2-methylthio-pyrimidine, 6-chloro-5-iodo-2-methylsulfanylpyrimidin-4-amine, 2-Methylmercapto-4-amino-5-iodo-6-chloropyrimidine, A1-62554
| Molecular Formula | C5H5ClIN3S |
|---|---|
| Molecular Weight | 300.89 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 77.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 300.89374 |
| Heavy Atoms | 11 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 500896-56-0 |
|---|---|
| SMILES | CSC1=NC(=C(C(=N1)Cl)I)N |
| InChIKey | QEGUVFRMAIHKIK-UHFFFAOYSA-N |
Product Overview
6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine (CAS 500896-56-0), with molecular formula C5H5ClIN3S and molecular weight 300.89 g/mol. IUPAC: 6-chloro-5-iodo-2-methylsulfanylpyrimidin-4-amine.
Chemical Property Profile of 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine
Property Insights of 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine. The TPSA of 77.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine. Following Lipinski's Rule of Five, 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine 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 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine?
The CAS number of 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine is 500896-56-0.
What is the molecular formula of 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine?
The molecular formula of 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine is C5H5ClIN3S.
What is the molecular weight of 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine?
The molecular weight of 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine is 300.89 g/mol.
Where can I buy 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine?
You can request a quote for 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-5-iodo-2-(methylthio)pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.