2-(1,3-benzothiazol-2-ylsulfanyl)-N-cyclopentylacetamide

Base Information

• Chemical Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-cyclopentylacetamide
• CAS No.: 313067-68-4
• Molecular Formula: C14H16N2OS2
• Molecular Weight: 292.42000
• DSSTox Substance ID: DTXSID001329996
• ChEMBL ID: CHEMBL1326680
• Mol file: 313067-68-4.mol

Synonyms:2-(1,3-benzothiazol-2-ylsulfanyl)-N-cyclopentylacetamide;MLS000762649;313067-68-4;SMR000438203;2-(Benzothiazol-2-ylsulfanyl)-N-cyclopentyl-acetamide;2-benzothiazol-2-ylthio-N-cyclopentylacetamide;Oprea1_350570;cid_755801;CHEMBL1326680;SCHEMBL12931687;BDBM45716;DTXSID001329996;HMS2796H04;STK058334;AKOS002505528;AG-205/06495039;SR-01000205969;SR-01000205969-1;2-(1,3-benzothiazol-2-ylthio)-N-cyclopentylacetamide;2-(1,3-benzothiazol-2-ylthio)-N-cyclopentyl-acetamide;2-(1,3-benzothiazol-2-ylsulfanyl)-N-cyclopentyl-ethanamide

Chemical Property of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-cyclopentylacetamide

Chemical Property:

• PSA: 95.53000
• LogP: 3.83810
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 292.07040549
• Heavy Atom Count: 19
• Complexity: 321

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCC(C1)NC(=O)CSC2=NC3=CC=CC=C3S2

Technology Process of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-cyclopentylacetamide

There total 1 articles about 2-(1,3-benzothiazol-2-ylsulfanyl)-N-cyclopentylacetamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 74.0%

(N-cyclopentyl)-2-chloroacetamide (125674-23-9) + sodium 2-mercaptobenzothiazole (2492-26-4) → C14H16N2OS2 (313067-68-4)

Guidance literature:

In N,N-dimethyl-formamide; at 60 ℃; for 5h;

upstream raw materials:

(N-cyclopentyl)-2-chloroacetamide

sodium 2-mercaptobenzothiazole