N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide
TL;DR: N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide (CAS 429653-99-6) is a chemical compound with molecular formula C13H8BrN5OS2 and molecular weight 392.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide
Also Known As: AM-879/40736082, N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide, 3-(2,1,3-BENZOTHIADIAZOL-4-YL)-1-(5-BROMOPYRIDINE-3-CARBONYL)THIOUREA, N-(2,1,3-benzothiadiazol-4-yl)-N'-[(5-bromopyridin-3-yl)carbonyl]thiourea
| Molecular Formula | C13H8BrN5OS2 |
|---|---|
| Molecular Weight | 392.94 g/mol |
| LogP | 2.9756 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 392.93536 |
| Heavy Atoms | 22 |
| Complexity | 866.2676 |
Chemical Identifiers
| CAS Number | 429653-99-6 |
|---|---|
| SMILES | C1=CC2=NSN=C2C(=C1)NC(=S)NC(=O)C3=CC(=CN=C3)Br |
Product Overview
N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide (CAS 429653-99-6), with molecular formula C13H8BrN5OS2 and molecular weight 392.94 g/mol. IUPAC: N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide.
Chemical Property Profile of N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide
Property Insights of N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide
The XLogP value of 2.9756 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide. Following Lipinski's Rule of Five, N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide has 2 hydrogen bond donor(s) and 6 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 N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide?
The CAS number of N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide is 429653-99-6.
What is the molecular formula of N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide?
The molecular formula of N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide is C13H8BrN5OS2.
What is the molecular weight of N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide?
The molecular weight of N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide is 392.94 g/mol.
Where can I buy N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide?
You can request a quote for N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.