4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride
TL;DR: 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride (CAS 28176-16-1) is a chemical compound with molecular formula C6H9ClN2S and molecular weight 176.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dimethyl-1H-pyrimidine-2-thione;hydrochloride
Also Known As: 4,6-Dimethyl-1H-pyrimidine-2-thione hydrochloride, 4,6-dimethylpyrimidine-2-thiol hydrochloride, EINECS 248-883-3, 4,6-dimethylpyrimidine-2(1h)-thione hydrochloride, EINECS 263-578-5
| Molecular Formula | C6H9ClN2S |
|---|---|
| Molecular Weight | 176.02 g/mol |
| LogP | 2.17783 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 176.0175 |
| Heavy Atoms | 10 |
| Complexity | 245.44548 |
Chemical Identifiers
| CAS Number | 28176-16-1 |
|---|---|
| SMILES | CC1=CC(=NC(=S)N1)C.Cl |
Product Overview
4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride (CAS 28176-16-1), with molecular formula C6H9ClN2S and molecular weight 176.02 g/mol. IUPAC: 4,6-dimethyl-1H-pyrimidine-2-thione;hydrochloride.
Chemical Property Profile of 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride
Property Insights of 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride
The XLogP value of 2.17783 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride. With a topological polar surface area (TPSA) of 28.68 Ų, 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-dimethyl-1H-pyrimidine-2-thione 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 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride?
The CAS number of 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride is 28176-16-1.
What is the molecular formula of 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride?
The molecular formula of 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride is C6H9ClN2S.
What is the molecular weight of 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride?
The molecular weight of 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride is 176.02 g/mol.
Where can I buy 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride?
You can request a quote for 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.