RefChem:404752
TL;DR: RefChem:404752 (CAS 623935-51-3) is a chemical compound with molecular formula C22H18ClN3O2S2 and molecular weight 455.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methylidene]-3-(2-methoxyethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: SALOR-INT L436879-1EA, (Z)-5-((3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-3-(2-methoxyethyl)-2-thioxothiazolidin-4-one, F1423-0647, (5Z)-5-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(2-methoxyethyl)-2-sulfanylidene-1,3-thiazolidin-4-one, (5Z)-5-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methylidene]-3-(2-methoxyethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C22H18ClN3O2S2 |
|---|---|
| Molecular Weight | 455.05 g/mol |
| LogP | 5.0403 |
| Topological Polar Surface Area | 47.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 455.0529 |
| Heavy Atoms | 30 |
| Complexity | 1111.1711 |
Chemical Identifiers
| CAS Number | 623935-51-3 |
|---|---|
| SMILES | COCCN1C(=O)/C(=C/C2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4)/SC1=S |
Product Overview
RefChem:404752 (CAS 623935-51-3), with molecular formula C22H18ClN3O2S2 and molecular weight 455.05 g/mol. IUPAC: (5Z)-5-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methylidene]-3-(2-methoxyethyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:404752
Property Insights of RefChem:404752
The XLogP value of 5.0403 indicates that RefChem:404752 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.36 Ų, RefChem:404752 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:404752 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:404752?
The CAS number of RefChem:404752 is 623935-51-3.
What is the molecular formula of RefChem:404752?
The molecular formula of RefChem:404752 is C22H18ClN3O2S2.
What is the molecular weight of RefChem:404752?
The molecular weight of RefChem:404752 is 455.05 g/mol.
Where can I buy RefChem:404752?
You can request a quote for RefChem:404752 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:404752?
Yes, KEHONG BIO provides custom synthesis services for RefChem:404752 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.