![2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone structure](/static/products/5402/5402-20-0.webp)
2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone
TL;DR: 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone (CAS 5402-20-0) is a chemical compound with molecular formula C16H13BrN4O2S and molecular weight 403.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone
Also Known As: 2-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone
| Molecular Formula | C16H13BrN4O2S |
|---|---|
| Molecular Weight | 403.99 g/mol |
| LogP | 3.4084 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 403.99426 |
| Heavy Atoms | 24 |
| Complexity | 834.0436 |
Chemical Identifiers
| CAS Number | 5402-20-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)CSC2=NN=NN2C3=CC=C(C=C3)Br |
Product Overview
2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone (CAS 5402-20-0), with molecular formula C16H13BrN4O2S and molecular weight 403.99 g/mol. IUPAC: 2-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone.
Chemical Property Profile of 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone
Property Insights of 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone
The XLogP value of 3.4084 indicates that 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone. Following Lipinski's Rule of Five, 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone has 0 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 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone?
The CAS number of 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone is 5402-20-0.
What is the molecular formula of 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone?
The molecular formula of 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone is C16H13BrN4O2S.
What is the molecular weight of 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone?
The molecular weight of 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone is 403.99 g/mol.
Where can I buy 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone?
You can request a quote for 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-[1-(4-Bromophenyl)tetrazol-5-yl]sulfanyl-1-(4-methoxyphenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.