3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide
TL;DR: 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide (CAS 130569-75-4) is a chemical compound with molecular formula C10H10BrF3N2O2S and molecular weight 357.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-imino-6-(trifluoromethoxy)-1,3-benzothiazol-3-yl]ethanol;hydrobromide
Also Known As: 2-(2-Imino-6-trifluoromethoxy-3-benzothiazolinyl)ethanol hydrobromide, 2-Imino-6-(trifluoromethoxy)-3(2H)-benzothiazoleethanol monohydrobromide, 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide, 2-[2-imino-6-(trifluoromethoxy)-1,3-benzothiazol-3-yl]ethanol hydrobromide, 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline hydrobromide
| Molecular Formula | C10H10BrF3N2O2S |
|---|---|
| Molecular Weight | 357.96 g/mol |
| LogP | 2.65107 |
| Topological Polar Surface Area | 58.24 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.95984 |
| Heavy Atoms | 19 |
| Complexity | 623.2428 |
Chemical Identifiers
| CAS Number | 130569-75-4 |
|---|---|
| SMILES | C1=CC2=C(C=C1OC(F)(F)F)SC(=N)N2CCO.Br |
Product Overview
3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide (CAS 130569-75-4), with molecular formula C10H10BrF3N2O2S and molecular weight 357.96 g/mol. IUPAC: 2-[2-imino-6-(trifluoromethoxy)-1,3-benzothiazol-3-yl]ethanol;hydrobromide.
Chemical Property Profile of 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide
Property Insights of 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide
The XLogP value of 2.65107 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide. With a topological polar surface area (TPSA) of 58.24 Ų, 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide has 2 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 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide?
The CAS number of 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide is 130569-75-4.
What is the molecular formula of 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide?
The molecular formula of 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide is C10H10BrF3N2O2S.
What is the molecular weight of 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide?
The molecular weight of 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide is 357.96 g/mol.
Where can I buy 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide?
You can request a quote for 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide?
Yes, KEHONG BIO provides custom synthesis services for 3(2H)-Benzothiazoleethanol, 2-imino-6-(trifluoromethoxy)-, monohydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.