Benzothiazole, 2-(2-ethoxyethoxy)-(9CI)
TL;DR: Benzothiazole, 2-(2-ethoxyethoxy)-(9CI) (CAS 415711-51-2) is a chemical compound with molecular formula C11H13NO2S and molecular weight 223.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-ethoxyethoxy)-1,3-benzothiazole
Also Known As: 2-(2-ethoxyethoxy)-1,3-benzothiazole, 2-(2-ethoxyethoxy)benzo[d]thiazole, Benzothiazole, 2-(2-ethoxyethoxy)- (9CI), BENZOTHIAZOLE, 2-(2-ETHOXYETHOXY)-
| Molecular Formula | C11H13NO2S |
|---|---|
| Molecular Weight | 223.07 g/mol |
| LogP | 2.7116 |
| Topological Polar Surface Area | 31.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 223.0667 |
| Heavy Atoms | 15 |
| Complexity | 394.20007 |
Chemical Identifiers
| CAS Number | 415711-51-2 |
|---|---|
| SMILES | CCOCCOC1=NC2=CC=CC=C2S1 |
Product Overview
Benzothiazole, 2-(2-ethoxyethoxy)-(9CI) (CAS 415711-51-2), with molecular formula C11H13NO2S and molecular weight 223.07 g/mol. IUPAC: 2-(2-ethoxyethoxy)-1,3-benzothiazole.
Chemical Property Profile of Benzothiazole, 2-(2-ethoxyethoxy)-(9CI)
Property Insights of Benzothiazole, 2-(2-ethoxyethoxy)-(9CI)
The XLogP value of 2.7116 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzothiazole, 2-(2-ethoxyethoxy)-(9CI). With a topological polar surface area (TPSA) of 31.35 Ų, Benzothiazole, 2-(2-ethoxyethoxy)-(9CI) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzothiazole, 2-(2-ethoxyethoxy)-(9CI) 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 Benzothiazole, 2-(2-ethoxyethoxy)-(9CI)?
The CAS number of Benzothiazole, 2-(2-ethoxyethoxy)-(9CI) is 415711-51-2.
What is the molecular formula of Benzothiazole, 2-(2-ethoxyethoxy)-(9CI)?
The molecular formula of Benzothiazole, 2-(2-ethoxyethoxy)-(9CI) is C11H13NO2S.
What is the molecular weight of Benzothiazole, 2-(2-ethoxyethoxy)-(9CI)?
The molecular weight of Benzothiazole, 2-(2-ethoxyethoxy)-(9CI) is 223.07 g/mol.
Where can I buy Benzothiazole, 2-(2-ethoxyethoxy)-(9CI)?
You can request a quote for Benzothiazole, 2-(2-ethoxyethoxy)-(9CI) 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-ethoxyethoxy)-(9CI)?
Yes, KEHONG BIO provides custom synthesis services for Benzothiazole, 2-(2-ethoxyethoxy)-(9CI) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.