5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide
TL;DR: 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide (CAS 429654-04-6) is a chemical compound with molecular formula C15H14BrN3OS2 and molecular weight 394.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide
Also Known As: AB00112041-01, AM-879/40736077, 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide, 3-(5-BROMOPYRIDINE-3-CARBONYL)-1-[2-(PHENYLSULFANYL)ETHYL]THIOUREA, 5-bromo-N-({[2-(phenylthio)ethyl]amino}carbonothioyl)nicotinamide
| Molecular Formula | C15H14BrN3OS2 |
|---|---|
| Molecular Weight | 394.98 g/mol |
| LogP | 3.2407 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.97617 |
| Heavy Atoms | 22 |
| Complexity | 652.24567 |
Chemical Identifiers
| CAS Number | 429654-04-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)SCCNC(=S)NC(=O)C2=CC(=CN=C2)Br |
Product Overview
5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide (CAS 429654-04-6), with molecular formula C15H14BrN3OS2 and molecular weight 394.98 g/mol. IUPAC: 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide.
Chemical Property Profile of 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide
Property Insights of 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide
The XLogP value of 3.2407 indicates that 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.02 Ų, 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide has 2 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 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide?
The CAS number of 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide is 429654-04-6.
What is the molecular formula of 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide?
The molecular formula of 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide is C15H14BrN3OS2.
What is the molecular weight of 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide?
The molecular weight of 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide is 394.98 g/mol.
Where can I buy 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide?
You can request a quote for 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.