2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide
TL;DR: 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide (CAS 332162-19-3) is a chemical compound with molecular formula C15H16N4O3S and molecular weight 332.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-methyl-3-nitrophenyl)acetamide
Also Known As: BAS 01248726, 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide, 2-(4,6-Dimethyl-pyrimidin-2-ylsulfanyl)-N-(4-methyl-3-nitro-phenyl)-acetamide, 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-methyl-3-nitrophenyl)acetamide, 2-(4,6-dimethylpyrimidin-2-ylthio)-N-(4-methyl-3-nitrophenyl)acetamide
| Molecular Formula | C15H16N4O3S |
|---|---|
| Molecular Weight | 332.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.0943 |
| Heavy Atoms | 23 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 332162-19-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)C)C)[N+](=O)[O-] |
| InChIKey | VVOFVUHLXYYLJI-UHFFFAOYSA-N |
Product Overview
2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide (CAS 332162-19-3), with molecular formula C15H16N4O3S and molecular weight 332.09 g/mol. IUPAC: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-methyl-3-nitrophenyl)acetamide.
Chemical Property Profile of 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide
Property Insights of 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide. Following Lipinski's Rule of Five, 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide has 1 hydrogen bond donor(s) and 6 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-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide?
The CAS number of 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide is 332162-19-3.
What is the molecular formula of 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide?
The molecular formula of 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide is C15H16N4O3S.
What is the molecular weight of 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide?
The molecular weight of 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide is 332.09 g/mol.
Where can I buy 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide?
You can request a quote for 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.