C17H15BrN6OS
TL;DR: C17H15BrN6OS (CAS 347912-69-0) is a chemical compound with molecular formula C17H15BrN6OS and molecular weight 430.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide
Also Known As: (E)-2-((5-(4-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-(pyridin-3-ylmethylene)acetohydrazide, 2-{[5-(4-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-pyridin-3-ylmethylidene]acetohydrazide
| Molecular Formula | C17H15BrN6OS |
|---|---|
| Molecular Weight | 430.02 g/mol |
| LogP | 2.882 |
| Topological Polar Surface Area | 85.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 430.02115 |
| Heavy Atoms | 26 |
| Complexity | 910.7623 |
Chemical Identifiers
| CAS Number | 347912-69-0 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)N/N=C/C2=CN=CC=C2)C3=CC=C(C=C3)Br |
Product Overview
C17H15BrN6OS (CAS 347912-69-0), with molecular formula C17H15BrN6OS and molecular weight 430.02 g/mol. IUPAC: 2-[[5-(4-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide.
Chemical Property Profile of C17H15BrN6OS
Property Insights of C17H15BrN6OS
The XLogP value of 2.882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C17H15BrN6OS. The TPSA of 85.06 Ų falls within the moderate polarity range, balancing permeability and solubility for C17H15BrN6OS. Following Lipinski's Rule of Five, C17H15BrN6OS has 1 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 C17H15BrN6OS?
The CAS number of C17H15BrN6OS is 347912-69-0.
What is the molecular formula of C17H15BrN6OS?
The molecular formula of C17H15BrN6OS is C17H15BrN6OS.
What is the molecular weight of C17H15BrN6OS?
The molecular weight of C17H15BrN6OS is 430.02 g/mol.
Where can I buy C17H15BrN6OS?
You can request a quote for C17H15BrN6OS directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C17H15BrN6OS?
Yes, KEHONG BIO provides custom synthesis services for C17H15BrN6OS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.