![Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide structure](/static/products/5335/5335-41-1.webp)
Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide
TL;DR: Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide (CAS 5335-41-1) is a chemical compound with molecular formula C15H14BrO2S+ and molecular weight 336.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-2-(2,6-dimethylpyrylium-4-yl)sulfanylethanone
Also Known As: NCIStruc1_001044, NCIStruc2_001043, NCI60_002430, Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide, 1-(4-bromophenyl)-2-(2,6-dimethylpyrylium-4-yl)sulfanylethanone
| Molecular Formula | C15H14BrO2S+ |
|---|---|
| Molecular Weight | 336.99 g/mol |
| LogP | 4.91504 |
| Topological Polar Surface Area | 28.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.98978 |
| Heavy Atoms | 19 |
| Complexity | 573.3446 |
Chemical Identifiers
| CAS Number | 5335-41-1 |
|---|---|
| SMILES | CC1=CC(=CC(=[O+]1)C)SCC(=O)C2=CC=C(C=C2)Br |
Product Overview
Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide (CAS 5335-41-1), with molecular formula C15H14BrO2S+ and molecular weight 336.99 g/mol. IUPAC: 1-(4-bromophenyl)-2-(2,6-dimethylpyrylium-4-yl)sulfanylethanone.
Chemical Property Profile of Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide
Property Insights of Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide
The XLogP value of 4.91504 indicates that Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.37 Ų, Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide has 0 hydrogen bond donor(s) and 2 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 Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide?
The CAS number of Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide is 5335-41-1.
What is the molecular formula of Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide?
The molecular formula of Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide is C15H14BrO2S+.
What is the molecular weight of Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide?
The molecular weight of Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide is 336.99 g/mol.
Where can I buy Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide?
You can request a quote for Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide?
Yes, KEHONG BIO provides custom synthesis services for Pyrylium, {4-[(p-bromophenacyl)thio]-2,6-dimethyl-,} bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.