![5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide structure](/static/products/4296/429650-65-7.webp)
5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide
TL;DR: 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide (CAS 429650-65-7) is a chemical compound with molecular formula C16H16BrN3O2S and molecular weight 393.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide
Also Known As: AB00111722-01, AM-879/40736081, 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide, 5-bromo-N-({[2-(3-methylphenoxy)ethyl]amino}carbonothioyl)nicotinamide, 5-bromo-N-{[2-(3-methylphenoxy)ethyl]carbamothioyl}pyridine-3-carboxamide
| Molecular Formula | C16H16BrN3O2S |
|---|---|
| Molecular Weight | 393.01 g/mol |
| LogP | 2.83582 |
| Topological Polar Surface Area | 63.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 393.01465 |
| Heavy Atoms | 23 |
| Complexity | 709.2296 |
Chemical Identifiers
| CAS Number | 429650-65-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OCCNC(=S)NC(=O)C2=CC(=CN=C2)Br |
Product Overview
5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide (CAS 429650-65-7), with molecular formula C16H16BrN3O2S and molecular weight 393.01 g/mol. IUPAC: 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide.
Chemical Property Profile of 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide
Property Insights of 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide
The XLogP value of 2.83582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide. The TPSA of 63.25 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide. Following Lipinski's Rule of Five, 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]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-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide?
The CAS number of 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide is 429650-65-7.
What is the molecular formula of 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide?
The molecular formula of 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide is C16H16BrN3O2S.
What is the molecular weight of 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide?
The molecular weight of 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide is 393.01 g/mol.
Where can I buy 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide?
You can request a quote for 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]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-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-N-[2-(3-methylphenoxy)ethylcarbamothioyl]pyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.