![4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide structure](/static/products/3390/339020-76-7.webp)
4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide
TL;DR: 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide (CAS 339020-76-7) is a chemical compound with molecular formula C19H22F3N7O5 and molecular weight 485.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[1-methyl-6-(methylamino)-3,5-dinitro-4H-pyridin-2-yl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Also Known As: 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide, 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydropyridin-2-yl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide, 4-[1-methyl-6-(methylamino)-3,5-dinitro-4H-pyridin-2-yl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
| Molecular Formula | C19H22F3N7O5 |
|---|---|
| Molecular Weight | 485.16 g/mol |
| LogP | 2.3014 |
| Topological Polar Surface Area | 137.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 485.16345 |
| Heavy Atoms | 34 |
| Complexity | 1064.6104 |
Chemical Identifiers
| CAS Number | 339020-76-7 |
|---|---|
| SMILES | CNC1=C(CC(=C(N1C)N2CCN(CC2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide (CAS 339020-76-7), with molecular formula C19H22F3N7O5 and molecular weight 485.16 g/mol. IUPAC: 4-[1-methyl-6-(methylamino)-3,5-dinitro-4H-pyridin-2-yl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide.
Chemical Property Profile of 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide
Property Insights of 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide
The XLogP value of 2.3014 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide. The TPSA of 137.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide. Following Lipinski's Rule of Five, 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide has 2 hydrogen bond donor(s) and 8 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-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide?
The CAS number of 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide is 339020-76-7.
What is the molecular formula of 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide?
The molecular formula of 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide is C19H22F3N7O5.
What is the molecular weight of 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide?
The molecular weight of 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide is 485.16 g/mol.
Where can I buy 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide?
You can request a quote for 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[1-methyl-6-(methylamino)-3,5-dinitro-1,4-dihydro-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.