2-Mercapto-4-methylpyrimidine hydrochloride
TL;DR: 2-Mercapto-4-methylpyrimidine hydrochloride (CAS 6959-66-6) is a chemical compound with molecular formula C5H7ClN2S and molecular weight 162.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-1H-pyrimidine-2-thione;hydrochloride
Also Known As: 2-Mercapto-4-methylpyrimidine hydrochloride, 4-Methylpyrimidine-2(1H)-thione hydrochloride, 4-Methylpyrimidine-2-thiol hydrochloride, 2-Mercapto-4-methylpyrimidine, 4-Methylpyrimidine-2-thiol HCl
| Molecular Formula | C5H7ClN2S |
|---|---|
| Molecular Weight | 162.00 g/mol |
| LogP | 1.86941 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 162.00185 |
| Heavy Atoms | 9 |
| Complexity | 232.39964 |
Chemical Identifiers
| CAS Number | 6959-66-6 |
|---|---|
| SMILES | CC1=CC=NC(=S)N1.Cl |
Product Overview
2-Mercapto-4-methylpyrimidine hydrochloride (CAS 6959-66-6), with molecular formula C5H7ClN2S and molecular weight 162.00 g/mol. IUPAC: 6-methyl-1H-pyrimidine-2-thione;hydrochloride.
Chemical Property Profile of 2-Mercapto-4-methylpyrimidine hydrochloride
Property Insights of 2-Mercapto-4-methylpyrimidine hydrochloride
The XLogP value of 1.86941 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Mercapto-4-methylpyrimidine hydrochloride. With a topological polar surface area (TPSA) of 28.68 Ų, 2-Mercapto-4-methylpyrimidine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Mercapto-4-methylpyrimidine hydrochloride has 1 hydrogen bond donor(s) and 2 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 2-Mercapto-4-methylpyrimidine hydrochloride?
The CAS number of 2-Mercapto-4-methylpyrimidine hydrochloride is 6959-66-6.
What is the molecular formula of 2-Mercapto-4-methylpyrimidine hydrochloride?
The molecular formula of 2-Mercapto-4-methylpyrimidine hydrochloride is C5H7ClN2S.
What is the molecular weight of 2-Mercapto-4-methylpyrimidine hydrochloride?
The molecular weight of 2-Mercapto-4-methylpyrimidine hydrochloride is 162.00 g/mol.
Where can I buy 2-Mercapto-4-methylpyrimidine hydrochloride?
You can request a quote for 2-Mercapto-4-methylpyrimidine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Mercapto-4-methylpyrimidine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Mercapto-4-methylpyrimidine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.