2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide
TL;DR: 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide (CAS 91285-82-4) is a chemical compound with molecular formula C14H20N4O3S and molecular weight 324.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide
Also Known As: 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide, 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-di, N~2~-tert-Butyl-3-[(methoxymethyl)carbamothioyl]pyridine-2,6-dicarboxamide, N2-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide, 2,6-Pyridinedicarboxamide,n2-(1,1-dimethylethyl)-3-[[(methoxymethyl)amino]thioxomethyl]-
| Molecular Formula | C14H20N4O3S |
|---|---|
| Molecular Weight | 324.13 g/mol |
| LogP | 0.5778 |
| Topological Polar Surface Area | 106.34 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.1256 |
| Heavy Atoms | 22 |
| Complexity | 596.241 |
Chemical Identifiers
| CAS Number | 91285-82-4 |
|---|---|
| SMILES | CC(C)(C)NC(=O)C1=C(C=CC(=N1)C(=O)N)C(=S)NCOC |
Product Overview
2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide (CAS 91285-82-4), with molecular formula C14H20N4O3S and molecular weight 324.13 g/mol. IUPAC: 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide.
Chemical Property Profile of 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide
Property Insights of 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide
The XLogP value of 0.5778 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide. The TPSA of 106.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide. Following Lipinski's Rule of Five, 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide has 3 hydrogen bond donor(s) and 5 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-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide?
The CAS number of 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide is 91285-82-4.
What is the molecular formula of 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide?
The molecular formula of 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide is C14H20N4O3S.
What is the molecular weight of 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide?
The molecular weight of 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide is 324.13 g/mol.
Where can I buy 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide?
You can request a quote for 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-N-tert-butyl-3-(methoxymethylcarbamothioyl)pyridine-2,6-dicarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.