Bionet1_004156
TL;DR: Bionet1_004156 (CAS 478077-59-7) is a chemical compound with molecular formula C17H16ClN5OS and molecular weight 373.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-(4-ethyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)pyridazin-4-one
Also Known As: Bionet1_004156, DivK1c_002652, CDS1_001612, 7P-642S, 3-[5-(allylsulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]-1-(4-chlorophenyl)-4(1H)-pyridazinone
| Molecular Formula | C17H16ClN5OS |
|---|---|
| Molecular Weight | 373.08 g/mol |
| LogP | 3.4424 |
| Topological Polar Surface Area | 65.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 373.07642 |
| Heavy Atoms | 25 |
| Complexity | 948.41724 |
Chemical Identifiers
| CAS Number | 478077-59-7 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC=C)C2=NN(C=CC2=O)C3=CC=C(C=C3)Cl |
Product Overview
Bionet1_004156 (CAS 478077-59-7), with molecular formula C17H16ClN5OS and molecular weight 373.08 g/mol. IUPAC: 1-(4-chlorophenyl)-3-(4-ethyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)pyridazin-4-one.
Chemical Property Profile of Bionet1_004156
Property Insights of Bionet1_004156
The XLogP value of 3.4424 indicates that Bionet1_004156 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_004156. Following Lipinski's Rule of Five, Bionet1_004156 has 0 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 Bionet1_004156?
The CAS number of Bionet1_004156 is 478077-59-7.
What is the molecular formula of Bionet1_004156?
The molecular formula of Bionet1_004156 is C17H16ClN5OS.
What is the molecular weight of Bionet1_004156?
The molecular weight of Bionet1_004156 is 373.08 g/mol.
Where can I buy Bionet1_004156?
You can request a quote for Bionet1_004156 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004156?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004156 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.