4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine
TL;DR: 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine (CAS 887570-45-8) is a chemical compound with molecular formula C6H8N4O3S and molecular weight 216.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-2-methylsulfanyl-5-nitropyrimidin-4-amine
Also Known As: 4-amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine, 6-methoxy-2-methylthio-5-nitropyrimidine-4-ylamine, 6-methoxy-2-methylsulfanyl-5-nitropyrimidin-4-amine, AB-323/25048270, 6-Methoxy-2-(methylthio)-5-nitropyrimidin-4-amine
| Molecular Formula | C6H8N4O3S |
|---|---|
| Molecular Weight | 216.03 g/mol |
| LogP | 0.6975 |
| Topological Polar Surface Area | 104.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.03171 |
| Heavy Atoms | 14 |
| Complexity | 370.33942 |
Chemical Identifiers
| CAS Number | 887570-45-8 |
|---|---|
| SMILES | COC1=NC(=NC(=C1[N+](=O)[O-])N)SC |
Product Overview
4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine (CAS 887570-45-8), with molecular formula C6H8N4O3S and molecular weight 216.03 g/mol. IUPAC: 6-methoxy-2-methylsulfanyl-5-nitropyrimidin-4-amine.
Chemical Property Profile of 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine
Property Insights of 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine
The XLogP value of 0.6975 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine. The TPSA of 104.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine. Following Lipinski's Rule of Five, 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine has 1 hydrogen bond donor(s) and 7 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-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine?
The CAS number of 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine is 887570-45-8.
What is the molecular formula of 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine?
The molecular formula of 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine is C6H8N4O3S.
What is the molecular weight of 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine?
The molecular weight of 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine is 216.03 g/mol.
Where can I buy 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine?
You can request a quote for 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-5-nitro-6-(methyloxy)-2-(methylsulfanyl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.