![methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate structure](/static/products/861/861633-77-4.png)
methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate
TL;DR: methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate (CAS 861633-77-4) is a chemical compound with molecular formula C17H15BrN4O3S and molecular weight 434.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[2-[(6-bromo-5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl]amino]benzoate
Also Known As: methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate, methyl 4-({[(6-bromo-5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl}amino)benzoate, methyl 4-[[2-[(6-bromo-5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl]amino]benzoate
| Molecular Formula | C17H15BrN4O3S |
|---|---|
| Molecular Weight | 434.00 g/mol |
| LogP | 3.54622 |
| Topological Polar Surface Area | 96.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 434.00482 |
| Heavy Atoms | 26 |
| Complexity | 933.04846 |
Chemical Identifiers
| CAS Number | 861633-77-4 |
|---|---|
| SMILES | CC1=C(C=C2C(=N1)N=C(N2)SCC(=O)NC3=CC=C(C=C3)C(=O)OC)Br |
Product Overview
methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate (CAS 861633-77-4), with molecular formula C17H15BrN4O3S and molecular weight 434.00 g/mol. IUPAC: methyl 4-[[2-[(6-bromo-5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate
Property Insights of methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate
The XLogP value of 3.54622 indicates that methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.97 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate. Following Lipinski's Rule of Five, methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate 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 methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate?
The CAS number of methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate is 861633-77-4.
What is the molecular formula of methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate?
The molecular formula of methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate is C17H15BrN4O3S.
What is the molecular weight of methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate?
The molecular weight of methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate is 434.00 g/mol.
Where can I buy methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate?
You can request a quote for methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-(2-((6-bromo-5-methyl-3H-imidazo[4,5-b]pyridin-2-yl)thio)acetamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.