BAS 00779086
TL;DR: BAS 00779086 (CAS 300377-80-4) is a chemical compound with molecular formula C17H11ClN2O3S2 and molecular weight 389.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-hydroxybenzamide
Also Known As: BAS 00779086, BIM-0022511.P001, AF-399/10512024, N-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-2-hydroxybenzamide, N-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-hydroxybenzamide
| Molecular Formula | C17H11ClN2O3S2 |
|---|---|
| Molecular Weight | 389.99 g/mol |
| LogP | 3.5918 |
| Topological Polar Surface Area | 69.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 389.98996 |
| Heavy Atoms | 25 |
| Complexity | 914.2709 |
Chemical Identifiers
| CAS Number | 300377-80-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)/C=C\2/C(=O)N(C(=S)S2)NC(=O)C3=CC=CC=C3O)Cl |
Product Overview
BAS 00779086 (CAS 300377-80-4), with molecular formula C17H11ClN2O3S2 and molecular weight 389.99 g/mol. IUPAC: N-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-hydroxybenzamide.
Chemical Property Profile of BAS 00779086
Property Insights of BAS 00779086
The XLogP value of 3.5918 indicates that BAS 00779086 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.64 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00779086. Following Lipinski's Rule of Five, BAS 00779086 has 2 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 BAS 00779086?
The CAS number of BAS 00779086 is 300377-80-4.
What is the molecular formula of BAS 00779086?
The molecular formula of BAS 00779086 is C17H11ClN2O3S2.
What is the molecular weight of BAS 00779086?
The molecular weight of BAS 00779086 is 389.99 g/mol.
Where can I buy BAS 00779086?
You can request a quote for BAS 00779086 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00779086?
Yes, KEHONG BIO provides custom synthesis services for BAS 00779086 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.