KSC-213-87-F
TL;DR: KSC-213-87-F (CAS 299906-20-0) is a chemical compound with molecular formula C17H11Cl2NO2S2 and molecular weight 394.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-benzyl-5-[(3,5-dichloro-4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: KSC-213-87-F, (5E)-3-benzyl-5-[(3,5-dichloro-4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, (5E)-3-benzyl-5-(3,5-dichloro-4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one, (5E)-3-benzyl-5-(3,5-dichloro-4-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one, (E)-3-benzyl-5-(3,5-dichloro-4-hydroxybenzylidene)-2-thioxothiazolidin-4-one
| Molecular Formula | C17H11Cl2NO2S2 |
|---|---|
| Molecular Weight | 394.96 g/mol |
| LogP | 5.1004 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 394.96082 |
| Heavy Atoms | 24 |
| Complexity | 829.91907 |
Chemical Identifiers
| CAS Number | 299906-20-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)/C(=C\C3=CC(=C(C(=C3)Cl)O)Cl)/SC2=S |
Product Overview
KSC-213-87-F (CAS 299906-20-0), with molecular formula C17H11Cl2NO2S2 and molecular weight 394.96 g/mol. IUPAC: (5E)-3-benzyl-5-[(3,5-dichloro-4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of KSC-213-87-F
Property Insights of KSC-213-87-F
The XLogP value of 5.1004 indicates that KSC-213-87-F is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.54 Ų, KSC-213-87-F exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KSC-213-87-F has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of KSC-213-87-F?
The CAS number of KSC-213-87-F is 299906-20-0.
What is the molecular formula of KSC-213-87-F?
The molecular formula of KSC-213-87-F is C17H11Cl2NO2S2.
What is the molecular weight of KSC-213-87-F?
The molecular weight of KSC-213-87-F is 394.96 g/mol.
Where can I buy KSC-213-87-F?
You can request a quote for KSC-213-87-F directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KSC-213-87-F?
Yes, KEHONG BIO provides custom synthesis services for KSC-213-87-F and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.