N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride
TL;DR: N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride (CAS 130997-71-6) is a chemical compound with molecular formula C14H17ClF3N3O2S and molecular weight 383.0682 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-ethyl-2-[4-ethyl-2-imino-6-(trifluoromethoxy)-1,3-benzothiazol-3-yl]acetamide;hydrochloride
Also Known As: N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride, N,N-Diethyl-2-imino-6-(trifluoromethoxy)-3(2H)-benzothiazoleacetamide monohydrochloride, 3(2H)-Benzothiazoleacetamide, N,N-diethyl-2-imino-6-(trifluoromethoxy)-, monohydrochloride, 3-Cyclopropylmethyl-2-imino-6-trifluoromethoxybenzothiazoline hydrobromide, N-Ethyl-2-[4-ethyl-2-imino-6-(trifluoromethoxy)-1,3-benzothiazol-3(2H)-yl]ethanimidic acid--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C14H17ClF3N3O2S |
| Molecular Weight | 383.0682 g/mol |
| XLogP | 3.20117 |
| Topological Polar Surface Area (TPSA) | 90.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 383.0682 Da |
| Heavy Atoms | 24 |
| Complexity | 461.0 |
| SMILES | CCC1=C2C(=CC(=C1)OC(F)(F)F)SC(=N)N2CC(=O)NCC.Cl |
| InChIKey | NPXBESKRQLVIKN-UHFFFAOYSA-N |
Chemical Property Profile of N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride
Property Insights of N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride
The XLogP value of 3.20117 indicates that N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride. Following Lipinski's Rule of Five, N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride?
The CAS number of N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride is 130997-71-6.
What is the molecular formula of N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride?
The molecular formula of N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride is C14H17ClF3N3O2S.
What is the molecular weight of N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride?
The molecular weight of N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride is 383.0682 g/mol.
Where can I buy N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride?
You can request a quote for N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride?
Yes, CoreyChem provides custom synthesis services for N,N-Diethyl-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)acetamide hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.