ChemDiv1_008111
TL;DR: ChemDiv1_008111 (CAS 433232-60-1) is a chemical compound with molecular formula C26H22N4O4S and molecular weight 486.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-2-[3-(4-methoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidin-4-one
Also Known As: ChemDiv1_008111, DivK1c_002751, CDS1_001711, 3-benzyl-2-[3-(4-methoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-1,3-thiazolidin-4-one, F1218-0260
| Molecular Formula | C26H22N4O4S |
|---|---|
| Molecular Weight | 486.14 g/mol |
| LogP | 5.2303 |
| Topological Polar Surface Area | 90.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 486.13617 |
| Heavy Atoms | 35 |
| Complexity | 1374.8845 |
Chemical Identifiers
| CAS Number | 433232-60-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NN(C=C2C3N(C(=O)CS3)CC4=CC=CC=C4)C5=CC=CC=C5)[N+](=O)[O-] |
Product Overview
ChemDiv1_008111 (CAS 433232-60-1), with molecular formula C26H22N4O4S and molecular weight 486.14 g/mol. IUPAC: 3-benzyl-2-[3-(4-methoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidin-4-one.
Chemical Property Profile of ChemDiv1_008111
Property Insights of ChemDiv1_008111
The XLogP value of 5.2303 indicates that ChemDiv1_008111 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.5 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_008111. Following Lipinski's Rule of Five, ChemDiv1_008111 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_008111?
The CAS number of ChemDiv1_008111 is 433232-60-1.
What is the molecular formula of ChemDiv1_008111?
The molecular formula of ChemDiv1_008111 is C26H22N4O4S.
What is the molecular weight of ChemDiv1_008111?
The molecular weight of ChemDiv1_008111 is 486.14 g/mol.
Where can I buy ChemDiv1_008111?
You can request a quote for ChemDiv1_008111 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_008111?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_008111 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.