C26H21N3OS2
TL;DR: C26H21N3OS2 (CAS 2718-78-7) is a chemical compound with molecular formula C26H21N3OS2 and molecular weight 455.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]-2-(N-phenylanilino)-1,3-thiazol-4-one
Also Known As: 4(5H)-Thiazolone, 2-(diphenylamino)-5-[(3-ethyl-2(3H)-benzothiazolylidene)ethylidene]-, 2-(DIPHENYLAMINO)-5-[(3-ETHYL-3H-BENZOTHIAZOL-2-YLIDENE)ETHYLIDENE]THIAZOL-4(5H)-ONE, 2-(Diphenylamino)-5-((3-ethyl-3H-benzothiazol-2-ylidene)ethylidene)thiazol-4(5H)-one, 4(5H)-Thiazolone, 2-(diphenylamino)-5-((3-ethyl-2(3H)-benzothiazolylidene)ethylidene)-, 4(5H)-Thiazolone, 2-(diphenylamino)-5-(2-(3-ethyl-2(3H)-benzothiazolylidene)ethylidene)-
| Molecular Formula | C26H21N3OS2 |
|---|---|
| Molecular Weight | 455.11 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 86.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 455.1126 |
| Heavy Atoms | 32 |
| Complexity | 762.0 |
Chemical Identifiers
| CAS Number | 2718-78-7 |
|---|---|
| SMILES | CCN1C2=CC=CC=C2SC1=CC=C3C(=O)N=C(S3)N(C4=CC=CC=C4)C5=CC=CC=C5 |
| InChIKey | BOMGUORSURCISS-UHFFFAOYSA-N |
Product Overview
C26H21N3OS2 (CAS 2718-78-7), with molecular formula C26H21N3OS2 and molecular weight 455.11 g/mol. IUPAC: 5-[2-(3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]-2-(N-phenylanilino)-1,3-thiazol-4-one.
Chemical Property Profile of C26H21N3OS2
Property Insights of C26H21N3OS2
The XLogP value of 6.8 indicates that C26H21N3OS2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.5 Ų falls within the moderate polarity range, balancing permeability and solubility for C26H21N3OS2. Following Lipinski's Rule of Five, C26H21N3OS2 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C26H21N3OS2?
The CAS number of C26H21N3OS2 is 2718-78-7.
What is the molecular formula of C26H21N3OS2?
The molecular formula of C26H21N3OS2 is C26H21N3OS2.
What is the molecular weight of C26H21N3OS2?
The molecular weight of C26H21N3OS2 is 455.11 g/mol.
Where can I buy C26H21N3OS2?
You can request a quote for C26H21N3OS2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C26H21N3OS2?
Yes, KEHONG BIO provides custom synthesis services for C26H21N3OS2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.