C17H13BrClN3OS3
TL;DR: C17H13BrClN3OS3 (CAS 672888-83-4) is a chemical compound with molecular formula C17H13BrClN3OS3 and molecular weight 484.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide
Also Known As: N-(4-bromophenyl)-2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide, N-(4-bromophenyl)-2-((5-((4-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)acetamide, N-(4-bromophenyl)-2-({5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide
| Molecular Formula | C17H13BrClN3OS3 |
|---|---|
| Molecular Weight | 484.91 g/mol |
| LogP | 5.9771 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 484.90927 |
| Heavy Atoms | 26 |
| Complexity | 871.7194 |
Chemical Identifiers
| CAS Number | 672888-83-4 |
|---|---|
| SMILES | C1=CC(=CC=C1CSC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)Br)Cl |
Product Overview
C17H13BrClN3OS3 (CAS 672888-83-4), with molecular formula C17H13BrClN3OS3 and molecular weight 484.91 g/mol. IUPAC: N-(4-bromophenyl)-2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide.
Chemical Property Profile of C17H13BrClN3OS3
Property Insights of C17H13BrClN3OS3
The XLogP value of 5.9771 indicates that C17H13BrClN3OS3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, C17H13BrClN3OS3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C17H13BrClN3OS3 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C17H13BrClN3OS3?
The CAS number of C17H13BrClN3OS3 is 672888-83-4.
What is the molecular formula of C17H13BrClN3OS3?
The molecular formula of C17H13BrClN3OS3 is C17H13BrClN3OS3.
What is the molecular weight of C17H13BrClN3OS3?
The molecular weight of C17H13BrClN3OS3 is 484.91 g/mol.
Where can I buy C17H13BrClN3OS3?
You can request a quote for C17H13BrClN3OS3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C17H13BrClN3OS3?
Yes, KEHONG BIO provides custom synthesis services for C17H13BrClN3OS3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.