Bionet1_003995
TL;DR: Bionet1_003995 (CAS 477863-20-0) is a chemical compound with molecular formula C13H8Cl2N4S2 and molecular weight 353.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2,6-dichlorophenyl)methylideneamino]-3-thiophen-2-yl-1H-1,2,4-triazole-5-thione
Also Known As: Bionet1_003995, DivK1c_002491, CDS1_001451, 4-[(2,6-dichlorophenyl)methylideneamino]-3-thiophen-2-yl-1H-1,2,4-triazole-5-thione, 4-[(Z)-(2,6-dichlorophenyl)methylideneamino]-3-thiophen-2-yl-1H-1,2,4-triazole-5-thione
| Molecular Formula | C13H8Cl2N4S2 |
|---|---|
| Molecular Weight | 353.96 g/mol |
| LogP | 4.85819 |
| Topological Polar Surface Area | 45.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 353.95676 |
| Heavy Atoms | 21 |
| Complexity | 829.186 |
Chemical Identifiers
| CAS Number | 477863-20-0 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)C=NN2C(=NNC2=S)C3=CC=CS3)Cl |
Product Overview
Bionet1_003995 (CAS 477863-20-0), with molecular formula C13H8Cl2N4S2 and molecular weight 353.96 g/mol. IUPAC: 4-[(2,6-dichlorophenyl)methylideneamino]-3-thiophen-2-yl-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of Bionet1_003995
Property Insights of Bionet1_003995
The XLogP value of 4.85819 indicates that Bionet1_003995 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.97 Ų, Bionet1_003995 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_003995 has 1 hydrogen bond donor(s) and 4 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_003995?
The CAS number of Bionet1_003995 is 477863-20-0.
What is the molecular formula of Bionet1_003995?
The molecular formula of Bionet1_003995 is C13H8Cl2N4S2.
What is the molecular weight of Bionet1_003995?
The molecular weight of Bionet1_003995 is 353.96 g/mol.
Where can I buy Bionet1_003995?
You can request a quote for Bionet1_003995 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_003995?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_003995 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.