BAS 00786545
TL;DR: BAS 00786545 (CAS 300558-01-4) is a chemical compound with molecular formula C18H14FNOS2 and molecular weight 343.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(3,4-dimethylphenyl)-5-[(4-fluorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 00786545, BIM-0005703.P001, (5Z)-3-(3,4-dimethylphenyl)-5-[(4-fluorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, 3-(3,4-dimethylphenyl)-5-(4-fluorobenzylidene)-2-thioxo-1,3-thiazolidin-4-one, (5Z)-3-(3,4-dimethylphenyl)-5-(4-fluorobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C18H14FNOS2 |
|---|---|
| Molecular Weight | 343.05 g/mol |
| LogP | 4.84834 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.05008 |
| Heavy Atoms | 23 |
| Complexity | 827.4153 |
Chemical Identifiers
| CAS Number | 300558-01-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C(=O)/C(=C/C3=CC=C(C=C3)F)/SC2=S)C |
Product Overview
BAS 00786545 (CAS 300558-01-4), with molecular formula C18H14FNOS2 and molecular weight 343.05 g/mol. IUPAC: (5Z)-3-(3,4-dimethylphenyl)-5-[(4-fluorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 00786545
Property Insights of BAS 00786545
The XLogP value of 4.84834 indicates that BAS 00786545 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, BAS 00786545 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00786545 has 0 hydrogen bond donor(s) and 3 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 00786545?
The CAS number of BAS 00786545 is 300558-01-4.
What is the molecular formula of BAS 00786545?
The molecular formula of BAS 00786545 is C18H14FNOS2.
What is the molecular weight of BAS 00786545?
The molecular weight of BAS 00786545 is 343.05 g/mol.
Where can I buy BAS 00786545?
You can request a quote for BAS 00786545 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00786545?
Yes, KEHONG BIO provides custom synthesis services for BAS 00786545 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.