5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone
TL;DR: 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone (CAS 378766-10-0) is a chemical compound with molecular formula C26H27N3O2S2 and molecular weight 477.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[3-(3-methyl-4-propan-2-yloxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-propyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone, 5-[[3-(3-methyl-4-propan-2-yloxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-propyl-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C26H27N3O2S2 |
|---|---|
| Molecular Weight | 477.15 g/mol |
| LogP | 6.24612 |
| Topological Polar Surface Area | 47.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 477.15448 |
| Heavy Atoms | 33 |
| Complexity | 1215.5299 |
Chemical Identifiers
| CAS Number | 378766-10-0 |
|---|---|
| SMILES | CCCN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OC(C)C)C)C4=CC=CC=C4)SC1=S |
Product Overview
5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone (CAS 378766-10-0), with molecular formula C26H27N3O2S2 and molecular weight 477.15 g/mol. IUPAC: 5-[[3-(3-methyl-4-propan-2-yloxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-propyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone
Property Insights of 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone
The XLogP value of 6.24612 indicates that 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.36 Ų, 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone 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 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone?
The CAS number of 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone is 378766-10-0.
What is the molecular formula of 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone?
The molecular formula of 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone is C26H27N3O2S2.
What is the molecular weight of 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone?
The molecular weight of 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone is 477.15 g/mol.
Where can I buy 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone?
You can request a quote for 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone?
Yes, KEHONG BIO provides custom synthesis services for 5-[[3-[3-Methyl-4-(1-methylethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-3-propyl-2-thioxo-4-thiazolidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.