C19H13ClFNOS2
TL;DR: C19H13ClFNOS2 (CAS 591744-76-2) is a chemical compound with molecular formula C19H13ClFNOS2 and molecular weight 389.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(3-chloro-4-fluorophenyl)-5-[(E)-2-methyl-3-phenylprop-2-enylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (Z)-3-(3-chloro-4-fluorophenyl)-5-((E)-2-methyl-3-phenylallylidene)-2-thioxothiazolidin-4-one, (5Z)-3-(3-chloro-4-fluorophenyl)-5-[(E)-2-methyl-3-phenylprop-2-enylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C19H13ClFNOS2 |
|---|---|
| Molecular Weight | 389.01 g/mol |
| LogP | 5.8312 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 389.0111 |
| Heavy Atoms | 25 |
| Complexity | 908.895 |
Chemical Identifiers
| CAS Number | 591744-76-2 |
|---|---|
| SMILES | C/C(=C\C1=CC=CC=C1)/C=C\2/C(=O)N(C(=S)S2)C3=CC(=C(C=C3)F)Cl |
Product Overview
C19H13ClFNOS2 (CAS 591744-76-2), with molecular formula C19H13ClFNOS2 and molecular weight 389.01 g/mol. IUPAC: (5Z)-3-(3-chloro-4-fluorophenyl)-5-[(E)-2-methyl-3-phenylprop-2-enylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of C19H13ClFNOS2
Property Insights of C19H13ClFNOS2
The XLogP value of 5.8312 indicates that C19H13ClFNOS2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, C19H13ClFNOS2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C19H13ClFNOS2 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 C19H13ClFNOS2?
The CAS number of C19H13ClFNOS2 is 591744-76-2.
What is the molecular formula of C19H13ClFNOS2?
The molecular formula of C19H13ClFNOS2 is C19H13ClFNOS2.
What is the molecular weight of C19H13ClFNOS2?
The molecular weight of C19H13ClFNOS2 is 389.01 g/mol.
Where can I buy C19H13ClFNOS2?
You can request a quote for C19H13ClFNOS2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C19H13ClFNOS2?
Yes, KEHONG BIO provides custom synthesis services for C19H13ClFNOS2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.