BAS 00751744
TL;DR: BAS 00751744 (CAS 5726-05-6) is a chemical compound with molecular formula C17H9ClF3NOS2 and molecular weight 398.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-(3-chlorophenyl)-2-sulfanylidene-5-[[3-(trifluoromethyl)phenyl]methylidene]-1,3-thiazolidin-4-one
Also Known As: BAS 00751744, BIM-0000684.P001, A1712/0072977, (5E)-3-(3-chlorophenyl)-2-sulfanylidene-5-[[3-(trifluoromethyl)phenyl]methylidene]-1,3-thiazolidin-4-one, (5E)-3-(3-CHLOROPHENYL)-2-SULFANYLIDENE-5-{[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}-1,3-THIAZOLIDIN-4-ONE
| Molecular Formula | C17H9ClF3NOS2 |
|---|---|
| Molecular Weight | 398.98 g/mol |
| LogP | 5.7646 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 398.97662 |
| Heavy Atoms | 25 |
| Complexity | 895.45685 |
Chemical Identifiers
| CAS Number | 5726-05-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)/C=C/2\C(=O)N(C(=S)S2)C3=CC(=CC=C3)Cl |
Product Overview
BAS 00751744 (CAS 5726-05-6), with molecular formula C17H9ClF3NOS2 and molecular weight 398.98 g/mol. IUPAC: (5E)-3-(3-chlorophenyl)-2-sulfanylidene-5-[[3-(trifluoromethyl)phenyl]methylidene]-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 00751744
Property Insights of BAS 00751744
The XLogP value of 5.7646 indicates that BAS 00751744 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 00751744 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00751744 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00751744?
The CAS number of BAS 00751744 is 5726-05-6.
What is the molecular formula of BAS 00751744?
The molecular formula of BAS 00751744 is C17H9ClF3NOS2.
What is the molecular weight of BAS 00751744?
The molecular weight of BAS 00751744 is 398.98 g/mol.
Where can I buy BAS 00751744?
You can request a quote for BAS 00751744 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00751744?
Yes, KEHONG BIO provides custom synthesis services for BAS 00751744 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.