RefChem:265288
TL;DR: RefChem:265288 (CAS 181586-86-7) is a chemical compound with molecular formula C26H22N2O3S and molecular weight 442.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenyl-5-[5-phenyl-3-(2,4,6-trimethylphenyl)-1,4,2-dioxazol-5-yl]-1,2-thiazol-3-one
Also Known As: NCI60_034832, 5-(3-Mesityl-5-phenyl-1,4,2-dioxazol-5-yl)-2-phenyl-3(2H)-isothiazolone, 2-Phenyl-5-[5-phenyl-3-(2,4,6-trimethylphenyl)-1,4,2-dioxazol-5-yl]-3(2H)-isothiazolone, 2-Phenyl-5-(5-phenyl-3-(2,4,6-trimethylphenyl)-1,4,2-dioxazol-5-yl)-3(2H)-isothiazolone, 2-phenyl-5-[5-phenyl-3-(2,4,6-trimethylphenyl)-1,4,2-dioxazol-5-yl]-1,2-thiazol-3-one
| Molecular Formula | C26H22N2O3S |
|---|---|
| Molecular Weight | 442.14 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 76.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 442.1351 |
| Heavy Atoms | 32 |
| Complexity | 759.0 |
Chemical Identifiers
| CAS Number | 181586-86-7 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)C2=NOC(O2)(C3=CC=CC=C3)C4=CC(=O)N(S4)C5=CC=CC=C5)C |
| InChIKey | OSKQJMMDJOLOOG-UHFFFAOYSA-N |
Product Overview
RefChem:265288 (CAS 181586-86-7), with molecular formula C26H22N2O3S and molecular weight 442.14 g/mol. IUPAC: 2-phenyl-5-[5-phenyl-3-(2,4,6-trimethylphenyl)-1,4,2-dioxazol-5-yl]-1,2-thiazol-3-one.
Chemical Property Profile of RefChem:265288
Property Insights of RefChem:265288
The XLogP value of 5.8 indicates that RefChem:265288 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:265288. Following Lipinski's Rule of Five, RefChem:265288 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:265288?
The CAS number of RefChem:265288 is 181586-86-7.
What is the molecular formula of RefChem:265288?
The molecular formula of RefChem:265288 is C26H22N2O3S.
What is the molecular weight of RefChem:265288?
The molecular weight of RefChem:265288 is 442.14 g/mol.
Where can I buy RefChem:265288?
You can request a quote for RefChem:265288 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:265288?
Yes, KEHONG BIO provides custom synthesis services for RefChem:265288 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.