5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole
TL;DR: 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole (CAS 43152-58-5) is a chemical compound with molecular formula C18H25NO3S and molecular weight 335.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-5-undecyl-1,3-benzothiazole-6,7-dione
Also Known As: UHDBT, 6-Hydroxy-5-undecyl-4,7-benzothiazoledione, 5-n-undecyl-6-hydroxy-4,7-dioxobenzothiazole, 4,7-Benzothiazoledione, 6-hydroxy-5-undecyl-, 4-hydroxy-5-undecyl-1,3-benzothiazole-6,7-dione
| Molecular Formula | C18H25NO3S |
|---|---|
| Molecular Weight | 335.16 g/mol |
| LogP | 5.0985 |
| Topological Polar Surface Area | 67.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 335.15552 |
| Heavy Atoms | 23 |
| Complexity | 588.8421 |
Chemical Identifiers
| CAS Number | 43152-58-5 |
|---|---|
| SMILES | CCCCCCCCCCCC1=C(C2=C(C(=O)C1=O)SC=N2)O |
Product Overview
5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole (CAS 43152-58-5), with molecular formula C18H25NO3S and molecular weight 335.16 g/mol. IUPAC: 4-hydroxy-5-undecyl-1,3-benzothiazole-6,7-dione.
Chemical Property Profile of 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole
Property Insights of 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole
The XLogP value of 5.0985 indicates that 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole. Following Lipinski's Rule of Five, 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole has 1 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-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole?
The CAS number of 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole is 43152-58-5.
What is the molecular formula of 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole?
The molecular formula of 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole is C18H25NO3S.
What is the molecular weight of 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole?
The molecular weight of 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole is 335.16 g/mol.
Where can I buy 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole?
You can request a quote for 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-n-Undecyl-6-hydroxy-4,7-dioxobenzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.