6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione
TL;DR: 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione (CAS 1002243-80-2) is a chemical compound with molecular formula C10H12N4S and molecular weight 220.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(1-ethyl-5-methylpyrazol-4-yl)-1H-pyrimidine-2-thione
Also Known As: 4-(1-ethyl-5-methyl-1H-pyrazol-4-yl)pyrimidine-2-thiol, 4-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-pyrimidine-2-thiol, 6-(1-ethyl-5-methylpyrazol-4-yl)-1H-pyrimidine-2-thione, 4-(1-ethyl-5-methylpyrazol-4-yl)pyrimidine-2-thiol, 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione
| Molecular Formula | C10H12N4S |
|---|---|
| Molecular Weight | 220.08 g/mol |
| LogP | 2.33101 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.07826 |
| Heavy Atoms | 15 |
| Complexity | 526.2138 |
Chemical Identifiers
| CAS Number | 1002243-80-2 |
|---|---|
| SMILES | CCN1C(=C(C=N1)C2=CC=NC(=S)N2)C |
Product Overview
6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione (CAS 1002243-80-2), with molecular formula C10H12N4S and molecular weight 220.08 g/mol. IUPAC: 6-(1-ethyl-5-methylpyrazol-4-yl)-1H-pyrimidine-2-thione.
Chemical Property Profile of 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione
Property Insights of 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione
The XLogP value of 2.33101 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione. With a topological polar surface area (TPSA) of 46.5 Ų, 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione has 1 hydrogen bond donor(s) and 3 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-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione?
The CAS number of 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione is 1002243-80-2.
What is the molecular formula of 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione?
The molecular formula of 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione is C10H12N4S.
What is the molecular weight of 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione?
The molecular weight of 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione is 220.08 g/mol.
Where can I buy 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione?
You can request a quote for 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione?
Yes, KEHONG BIO provides custom synthesis services for 6-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-2(1H)-pyrimidinethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.