Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)-
TL;DR: Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)- (CAS 127142-35-2) is a chemical compound with molecular formula C16H15F3N6S2 and molecular weight 412.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-1-pyridin-2-ylethylideneamino]-3-[[2-(trifluoromethyl)phenyl]carbamothioylamino]thiourea
Also Known As: Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)-, 1-[(E)-1-(2-pyridyl)ethylideneamino]-3-[[2-(trifluoromethyl)phenyl]carbamothioylamino]thiourea, 1-[(E)-1-pyridin-2-ylethylideneamino]-3-[[2-(trifluoromethyl)phenyl]carbamothioylamino]thiourea, 1-[1-(2-Pyridinyl)ethylidene]-5-[2-trifluoromethylphenylamino(thiocarbonyl)]thiocarbonohydrazide, 1-{[1-(pyridin-2-yl)ethylidene]amino}-3-({[2-(trifluoromethyl)phenyl]carbamothioyl}amino)thiourea
| Molecular Formula | C16H15F3N6S2 |
|---|---|
| Molecular Weight | 412.08 g/mol |
| LogP | 3.1901 |
| Topological Polar Surface Area | 73.37 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 412.07516 |
| Heavy Atoms | 27 |
| Complexity | 839.5493 |
Chemical Identifiers
| CAS Number | 127142-35-2 |
|---|---|
| SMILES | C/C(=N\NC(=S)NNC(=S)NC1=CC=CC=C1C(F)(F)F)/C2=CC=CC=N2 |
Product Overview
Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)- (CAS 127142-35-2), with molecular formula C16H15F3N6S2 and molecular weight 412.08 g/mol. IUPAC: 1-[(E)-1-pyridin-2-ylethylideneamino]-3-[[2-(trifluoromethyl)phenyl]carbamothioylamino]thiourea.
Chemical Property Profile of Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)-
Property Insights of Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)-
The XLogP value of 3.1901 indicates that Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.37 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)-. Following Lipinski's Rule of Five, Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)- has 4 hydrogen bond donor(s) and 4 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 Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)-?
The CAS number of Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)- is 127142-35-2.
What is the molecular formula of Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)-?
The molecular formula of Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)- is C16H15F3N6S2.
What is the molecular weight of Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)-?
The molecular weight of Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)- is 412.08 g/mol.
Where can I buy Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)-?
You can request a quote for Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)-?
Yes, KEHONG BIO provides custom synthesis services for Carbonothioic dihydrazide, N''-((1E)-1-(2-pyridinyl)ethylidene)-N'''-(thioxo((2-(trifluoromethyl)phenyl)amino)methyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.