2-Pyrimidineacetamide, 4,6-dimethylthio-
TL;DR: 2-Pyrimidineacetamide, 4,6-dimethylthio- (CAS 25948-02-1) is a chemical compound with molecular formula C8H11N3S and molecular weight 181.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4,6-dimethylpyrimidin-2-yl)ethanethioamide
Also Known As: 2-Pyrimidineacetamide, 4,6-dimethylthio-, 4,6-Dimethylthio-2-pyrimidineacetamide, 2-Pyrimidineethanethioamide, 4,6-dimethyl-, 5-25-04-00213 (Beilstein Handbook Reference), 2-(4,6-dimethylpyrimidin-2-yl)ethanethioamide
| Molecular Formula | C8H11N3S |
|---|---|
| Molecular Weight | 181.07 g/mol |
| LogP | 0.92204 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.06737 |
| Heavy Atoms | 12 |
| Complexity | 288.92133 |
Chemical Identifiers
| CAS Number | 25948-02-1 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)CC(=S)N)C |
Product Overview
2-Pyrimidineacetamide, 4,6-dimethylthio- (CAS 25948-02-1), with molecular formula C8H11N3S and molecular weight 181.07 g/mol. IUPAC: 2-(4,6-dimethylpyrimidin-2-yl)ethanethioamide.
Chemical Property Profile of 2-Pyrimidineacetamide, 4,6-dimethylthio-
Property Insights of 2-Pyrimidineacetamide, 4,6-dimethylthio-
The XLogP value of 0.92204 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrimidineacetamide, 4,6-dimethylthio-. With a topological polar surface area (TPSA) of 51.8 Ų, 2-Pyrimidineacetamide, 4,6-dimethylthio- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrimidineacetamide, 4,6-dimethylthio- 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 2-Pyrimidineacetamide, 4,6-dimethylthio-?
The CAS number of 2-Pyrimidineacetamide, 4,6-dimethylthio- is 25948-02-1.
What is the molecular formula of 2-Pyrimidineacetamide, 4,6-dimethylthio-?
The molecular formula of 2-Pyrimidineacetamide, 4,6-dimethylthio- is C8H11N3S.
What is the molecular weight of 2-Pyrimidineacetamide, 4,6-dimethylthio-?
The molecular weight of 2-Pyrimidineacetamide, 4,6-dimethylthio- is 181.07 g/mol.
Where can I buy 2-Pyrimidineacetamide, 4,6-dimethylthio-?
You can request a quote for 2-Pyrimidineacetamide, 4,6-dimethylthio- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrimidineacetamide, 4,6-dimethylthio-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrimidineacetamide, 4,6-dimethylthio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.