C19H17BrClN5OS
TL;DR: C19H17BrClN5OS (CAS 348100-65-2) is a chemical compound with molecular formula C19H17BrClN5OS and molecular weight 477.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1-(4-bromophenyl)ethylideneamino]-2-[[5-(3-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: (E)-N'-(1-(4-bromophenyl)ethylidene)-2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide, N'-[(1E)-1-(4-bromophenyl)ethylidene]-2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
| Molecular Formula | C19H17BrClN5OS |
|---|---|
| Molecular Weight | 477.00 g/mol |
| LogP | 4.5305 |
| Topological Polar Surface Area | 72.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 477.00256 |
| Heavy Atoms | 28 |
| Complexity | 1019.4184 |
Chemical Identifiers
| CAS Number | 348100-65-2 |
|---|---|
| SMILES | C/C(=N\NC(=O)CSC1=NN=C(N1C)C2=CC(=CC=C2)Cl)/C3=CC=C(C=C3)Br |
Product Overview
C19H17BrClN5OS (CAS 348100-65-2), with molecular formula C19H17BrClN5OS and molecular weight 477.00 g/mol. IUPAC: N-[(E)-1-(4-bromophenyl)ethylideneamino]-2-[[5-(3-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of C19H17BrClN5OS
Property Insights of C19H17BrClN5OS
The XLogP value of 4.5305 indicates that C19H17BrClN5OS is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.17 Ų falls within the moderate polarity range, balancing permeability and solubility for C19H17BrClN5OS. Following Lipinski's Rule of Five, C19H17BrClN5OS has 1 hydrogen bond donor(s) and 5 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 C19H17BrClN5OS?
The CAS number of C19H17BrClN5OS is 348100-65-2.
What is the molecular formula of C19H17BrClN5OS?
The molecular formula of C19H17BrClN5OS is C19H17BrClN5OS.
What is the molecular weight of C19H17BrClN5OS?
The molecular weight of C19H17BrClN5OS is 477.00 g/mol.
Where can I buy C19H17BrClN5OS?
You can request a quote for C19H17BrClN5OS directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C19H17BrClN5OS?
Yes, KEHONG BIO provides custom synthesis services for C19H17BrClN5OS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.