TRC-4186 cation
TL;DR: TRC-4186 cation (CAS 741241-58-7) is a chemical compound with molecular formula C13H14N3O4S2+ and molecular weight 340.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-methylsulfonyl-1-(2-oxo-2-thiophen-2-ylethyl)pyridin-1-ium-3-carbohydrazide
Also Known As: TRC-4186 cation, Pyridinium, 3-((2-(methylsulfonyl)hydrazinyl)carbonyl)-1-(2-oxo-2-(2-thienyl)ethyl)-, N'-methylsulfonyl-1-(2-oxo-2-thiophen-2-yl-ethyl)pyridine-5-carbohydrazide
| Molecular Formula | C13H14N3O4S2+ |
|---|---|
| Molecular Weight | 340.04 g/mol |
| LogP | 0.1125 |
| Topological Polar Surface Area | 96.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 340.04257 |
| Heavy Atoms | 22 |
| Complexity | 785.37634 |
Chemical Identifiers
| CAS Number | 741241-58-7 |
|---|---|
| SMILES | CS(=O)(=O)NNC(=O)C1=C[N+](=CC=C1)CC(=O)C2=CC=CS2 |
Product Overview
TRC-4186 cation (CAS 741241-58-7), with molecular formula C13H14N3O4S2+ and molecular weight 340.04 g/mol. IUPAC: N'-methylsulfonyl-1-(2-oxo-2-thiophen-2-ylethyl)pyridin-1-ium-3-carbohydrazide.
Chemical Property Profile of TRC-4186 cation
Property Insights of TRC-4186 cation
The XLogP value of 0.1125 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TRC-4186 cation. The TPSA of 96.22 Ų falls within the moderate polarity range, balancing permeability and solubility for TRC-4186 cation. Following Lipinski's Rule of Five, TRC-4186 cation has 2 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 TRC-4186 cation?
The CAS number of TRC-4186 cation is 741241-58-7.
What is the molecular formula of TRC-4186 cation?
The molecular formula of TRC-4186 cation is C13H14N3O4S2+.
What is the molecular weight of TRC-4186 cation?
The molecular weight of TRC-4186 cation is 340.04 g/mol.
Where can I buy TRC-4186 cation?
You can request a quote for TRC-4186 cation directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TRC-4186 cation?
Yes, KEHONG BIO provides custom synthesis services for TRC-4186 cation and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.