Bionet1_004438
TL;DR: Bionet1_004438 (CAS 478077-87-1) is a chemical compound with molecular formula C16H11N5OS2 and molecular weight 353.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-5-(thiophen-2-ylmethylidene)-2-(1,2,4-triazol-4-ylimino)-1,3-thiazolidin-4-one
Also Known As: Bionet1_004438, 3-phenyl-5-[(Z)-2-thienylmethylidene]-2-(4H-1,2,4-triazol-4-ylimino)-1,3-thiazolan-4-one, 3-phenyl-5-(thiophen-2-ylmethylidene)-2-(1,2,4-triazol-4-ylimino)-1,3-thiazolidin-4-one, 3-phenyl-5-(2-thienylmethylene)-2-(1,2,4-triazol-4-ylimino)thiazolidin-4-one, C16H11N5OS2
| Molecular Formula | C16H11N5OS2 |
|---|---|
| Molecular Weight | 353.04 g/mol |
| LogP | 3.2798 |
| Topological Polar Surface Area | 63.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 353.0405 |
| Heavy Atoms | 24 |
| Complexity | 901.37286 |
Chemical Identifiers
| CAS Number | 478077-87-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CS3)SC2=NN4C=NN=C4 |
Product Overview
Bionet1_004438 (CAS 478077-87-1), with molecular formula C16H11N5OS2 and molecular weight 353.04 g/mol. IUPAC: 3-phenyl-5-(thiophen-2-ylmethylidene)-2-(1,2,4-triazol-4-ylimino)-1,3-thiazolidin-4-one.
Chemical Property Profile of Bionet1_004438
Property Insights of Bionet1_004438
The XLogP value of 3.2798 indicates that Bionet1_004438 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.38 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_004438. Following Lipinski's Rule of Five, Bionet1_004438 has 0 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 Bionet1_004438?
The CAS number of Bionet1_004438 is 478077-87-1.
What is the molecular formula of Bionet1_004438?
The molecular formula of Bionet1_004438 is C16H11N5OS2.
What is the molecular weight of Bionet1_004438?
The molecular weight of Bionet1_004438 is 353.04 g/mol.
Where can I buy Bionet1_004438?
You can request a quote for Bionet1_004438 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004438?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004438 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.