Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)-
TL;DR: Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)- (CAS 67723-95-9) is a chemical compound with molecular formula C13H12N2S3 and molecular weight 292.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-propan-2-ylsulfanyl-1,3-thiazol-4-yl)-1,3-benzothiazole
Also Known As: Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)-, 2-(2-((1-Methylethyl)thio)-4-thiazolyl)benzothiazole, 2-(2-propan-2-ylsulfanyl-1,3-thiazol-4-yl)-1,3-benzothiazole, 2-{2-[(Propan-2-yl)sulfanyl]-1,3-thiazol-4-yl}-1,3-benzothiazole, BRN 0805273
| Molecular Formula | C13H12N2S3 |
|---|---|
| Molecular Weight | 292.02 g/mol |
| LogP | 4.9203 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.01627 |
| Heavy Atoms | 18 |
| Complexity | 636.4946 |
Chemical Identifiers
| CAS Number | 67723-95-9 |
|---|---|
| SMILES | CC(C)SC1=NC(=CS1)C2=NC3=CC=CC=C3S2 |
Product Overview
Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)- (CAS 67723-95-9), with molecular formula C13H12N2S3 and molecular weight 292.02 g/mol. IUPAC: 2-(2-propan-2-ylsulfanyl-1,3-thiazol-4-yl)-1,3-benzothiazole.
Chemical Property Profile of Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)-
Property Insights of Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)-
The XLogP value of 4.9203 indicates that Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)- has 0 hydrogen bond donor(s) and 5 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 Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)-?
The CAS number of Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)- is 67723-95-9.
What is the molecular formula of Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)-?
The molecular formula of Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)- is C13H12N2S3.
What is the molecular weight of Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)-?
The molecular weight of Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)- is 292.02 g/mol.
Where can I buy Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)-?
You can request a quote for Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzothiazole, 2-(2-((1-methylethyl)thio)-4-thiazolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.