![2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide structure](/static/products/831/831246-55-0.png)
2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide
TL;DR: 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide (CAS 831246-55-0) is a chemical compound with molecular formula C14H13BrN2OS and molecular weight 335.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-bromophenyl)methylsulfanyl]-N-pyridin-3-ylacetamide
Also Known As: 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide, 2-[(4-bromophenyl)methylsulfanyl]-N-pyridin-3-ylacetamide
| Molecular Formula | C14H13BrN2OS |
|---|---|
| Molecular Weight | 335.99 g/mol |
| LogP | 3.716 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.9932 |
| Heavy Atoms | 19 |
| Complexity | 530.90204 |
Chemical Identifiers
| CAS Number | 831246-55-0 |
|---|---|
| SMILES | C1=CC(=CN=C1)NC(=O)CSCC2=CC=C(C=C2)Br |
Product Overview
2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide (CAS 831246-55-0), with molecular formula C14H13BrN2OS and molecular weight 335.99 g/mol. IUPAC: 2-[(4-bromophenyl)methylsulfanyl]-N-pyridin-3-ylacetamide.
Chemical Property Profile of 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide
Property Insights of 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide
The XLogP value of 3.716 indicates that 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide has 1 hydrogen bond donor(s) and 3 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 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide?
The CAS number of 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide is 831246-55-0.
What is the molecular formula of 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide?
The molecular formula of 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide is C14H13BrN2OS.
What is the molecular weight of 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide?
The molecular weight of 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide is 335.99 g/mol.
Where can I buy 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide?
You can request a quote for 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-bromobenzyl)sulfanyl]-N-(pyridin-3-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.