2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole
TL;DR: 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole (CAS 65558-22-7) is a chemical compound with molecular formula C15H13NOS2 and molecular weight 287.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-phenoxyethylsulfanyl)-1,3-benzothiazole
Also Known As: 2-(2-phenoxyethylsulfanyl)-1,3-benzothiazole, 2-(2-phenoxyethylsulfanyl)benzothiazole, 3-bromo-4,4-dimethoxy-2-butanone, BAS 01063664, 2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazole
| Molecular Formula | C15H13NOS2 |
|---|---|
| Molecular Weight | 287.04 g/mol |
| LogP | 4.4674 |
| Topological Polar Surface Area | 22.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 287.04385 |
| Heavy Atoms | 19 |
| Complexity | 618.31415 |
Chemical Identifiers
| CAS Number | 65558-22-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3S2 |
Product Overview
2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole (CAS 65558-22-7), with molecular formula C15H13NOS2 and molecular weight 287.04 g/mol. IUPAC: 2-(2-phenoxyethylsulfanyl)-1,3-benzothiazole.
Chemical Property Profile of 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole
Property Insights of 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole
The XLogP value of 4.4674 indicates that 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.12 Ų, 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole?
The CAS number of 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole is 65558-22-7.
What is the molecular formula of 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole?
The molecular formula of 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole is C15H13NOS2.
What is the molecular weight of 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole?
The molecular weight of 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole is 287.04 g/mol.
Where can I buy 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole?
You can request a quote for 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Phenoxyethylsulfanyl)-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.