6-methylsulfanylpyrimidine-4-carboxylic Acid
TL;DR: 6-methylsulfanylpyrimidine-4-carboxylic Acid (CAS 301342-78-9) is a chemical compound with molecular formula C6H6N2O2S and molecular weight 170.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methylsulfanylpyrimidine-4-carboxylic acid
Also Known As: 6-(methylthio)pyrimidine-4-carboxylic acid, 6-methylsulfanylpyrimidine-4-carboxylic Acid, 6-(methylsulfanyl)pyrimidine-4-carboxylic acid, 4-Pyrimidinecarboxylicacid, 6-(methylthio)-, 4-Pyrimidinecarboxylicacid,6-(methylthio)-(9CI)
| Molecular Formula | C6H6N2O2S |
|---|---|
| Molecular Weight | 170.01 g/mol |
| LogP | 0.8967 |
| Topological Polar Surface Area | 63.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.015 |
| Heavy Atoms | 11 |
| Complexity | 277.03973 |
Chemical Identifiers
| CAS Number | 301342-78-9 |
|---|---|
| SMILES | CSC1=NC=NC(=C1)C(=O)O |
Product Overview
6-methylsulfanylpyrimidine-4-carboxylic Acid (CAS 301342-78-9), with molecular formula C6H6N2O2S and molecular weight 170.01 g/mol. IUPAC: 6-methylsulfanylpyrimidine-4-carboxylic acid.
Chemical Property Profile of 6-methylsulfanylpyrimidine-4-carboxylic Acid
Property Insights of 6-methylsulfanylpyrimidine-4-carboxylic Acid
The XLogP value of 0.8967 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-methylsulfanylpyrimidine-4-carboxylic Acid. The TPSA of 63.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-methylsulfanylpyrimidine-4-carboxylic Acid. Following Lipinski's Rule of Five, 6-methylsulfanylpyrimidine-4-carboxylic Acid 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-methylsulfanylpyrimidine-4-carboxylic Acid?
The CAS number of 6-methylsulfanylpyrimidine-4-carboxylic Acid is 301342-78-9.
What is the molecular formula of 6-methylsulfanylpyrimidine-4-carboxylic Acid?
The molecular formula of 6-methylsulfanylpyrimidine-4-carboxylic Acid is C6H6N2O2S.
What is the molecular weight of 6-methylsulfanylpyrimidine-4-carboxylic Acid?
The molecular weight of 6-methylsulfanylpyrimidine-4-carboxylic Acid is 170.01 g/mol.
Where can I buy 6-methylsulfanylpyrimidine-4-carboxylic Acid?
You can request a quote for 6-methylsulfanylpyrimidine-4-carboxylic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-methylsulfanylpyrimidine-4-carboxylic Acid?
Yes, KEHONG BIO provides custom synthesis services for 6-methylsulfanylpyrimidine-4-carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.