RefChem:404654
TL;DR: RefChem:404654 (CAS 623935-74-0) is a chemical compound with molecular formula C26H25N3O4S2 and molecular weight 507.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (5Z)-5-{[3-(3,4-dimethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-3-(tetrahydro-2-furanylmethyl)-2-thioxo-1,3-thiazolidin-4-one, 5-((3-(3,4-Dimethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((tetrahydrofuran-2-yl)methyl)-2-thioxothiazolidin-4-one, (5Z)-5-((3-(3,4-DIMETHOXYPHENYL)-1-PHENYL-1H-PYRAZOL-4-YL)METHYLENE)-3-(TETRAHYDRO-2-FURANYLMETHYL)-2-THIOXO-1,3-THIAZOLIDIN-4-ONE, (5Z)-5-[[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one, (5Z)-5-{[3-(3,4-dimethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C26H25N3O4S2 |
|---|---|
| Molecular Weight | 507.13 g/mol |
| LogP | 4.9367 |
| Topological Polar Surface Area | 65.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 507.12866 |
| Heavy Atoms | 35 |
| Complexity | 1283.0039 |
Chemical Identifiers
| CAS Number | 623935-74-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NN(C=C2/C=C\3/C(=O)N(C(=S)S3)CC4CCCO4)C5=CC=CC=C5)OC |
Product Overview
RefChem:404654 (CAS 623935-74-0), with molecular formula C26H25N3O4S2 and molecular weight 507.13 g/mol. IUPAC: (5Z)-5-[[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:404654
Property Insights of RefChem:404654
The XLogP value of 4.9367 indicates that RefChem:404654 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.82 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:404654. Following Lipinski's Rule of Five, RefChem:404654 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:404654?
The CAS number of RefChem:404654 is 623935-74-0.
What is the molecular formula of RefChem:404654?
The molecular formula of RefChem:404654 is C26H25N3O4S2.
What is the molecular weight of RefChem:404654?
The molecular weight of RefChem:404654 is 507.13 g/mol.
Where can I buy RefChem:404654?
You can request a quote for RefChem:404654 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:404654?
Yes, KEHONG BIO provides custom synthesis services for RefChem:404654 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.