ChemDiv1_001690
TL;DR: ChemDiv1_001690 (CAS 303055-77-8) is a chemical compound with molecular formula C18H19Cl2N3O2S2 and molecular weight 443.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(2,4-dichlorophenyl)methylidene]-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: ChemDiv1_001690, (5E)-5-(2,4-dichlorobenzylidene)-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-thioxo-1,3-thiazolidin-4-one, (5E)-5-[(2,4-dichlorophenyl)methylidene]-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-sulfanylidene-1,3-thiazolidin-4-one, (E)-5-(2,4-dichlorobenzylidene)-3-(3-(4-methylpiperazin-1-yl)-3-oxopropyl)-2-thioxothiazolidin-4-one, 5-[(2,4-dichlorophenyl)methylene]-3-[3-(4-methylpiperazinyl)-3-oxopropyl]-2-th ioxo-1,3-thiazolidin-4-one
| Molecular Formula | C18H19Cl2N3O2S2 |
|---|---|
| Molecular Weight | 443.03 g/mol |
| LogP | 3.3587 |
| Topological Polar Surface Area | 43.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 443.02957 |
| Heavy Atoms | 27 |
| Complexity | 807.7965 |
Chemical Identifiers
| CAS Number | 303055-77-8 |
|---|---|
| SMILES | CN1CCN(CC1)C(=O)CCN2C(=O)/C(=C\C3=C(C=C(C=C3)Cl)Cl)/SC2=S |
Product Overview
ChemDiv1_001690 (CAS 303055-77-8), with molecular formula C18H19Cl2N3O2S2 and molecular weight 443.03 g/mol. IUPAC: (5E)-5-[(2,4-dichlorophenyl)methylidene]-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of ChemDiv1_001690
Property Insights of ChemDiv1_001690
The XLogP value of 3.3587 indicates that ChemDiv1_001690 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.86 Ų, ChemDiv1_001690 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_001690 has 0 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 ChemDiv1_001690?
The CAS number of ChemDiv1_001690 is 303055-77-8.
What is the molecular formula of ChemDiv1_001690?
The molecular formula of ChemDiv1_001690 is C18H19Cl2N3O2S2.
What is the molecular weight of ChemDiv1_001690?
The molecular weight of ChemDiv1_001690 is 443.03 g/mol.
Where can I buy ChemDiv1_001690?
You can request a quote for ChemDiv1_001690 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_001690?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_001690 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.