2-(Benzylsulfanyl)-1,3-benzothiazole
2-benzylsulfanyl-1,3-benzothiazole
Also Known As: 2-(benzylthio)benzo[d]thiazole|2-Benzylsulfanyl-benzothiazole|2-(benzylsulfanyl)-1,3-benzothiazole|2-benzylthiobenzothiazole|2-(Benzylthio)benzothiazole|2-Benzylsulfanylbenzothiazole|benzylsulfanyl-benzothiazole|2-benzylsulfanyl-1,3-benzothiazole|2-benzylmercaptobenzothiazole|2-Benzothiazolylbenzyl sulfide|Benzyl 2-benzothiazolyl sulfide|2-(phenylmethylthio)benzothiazole|Benzyl(benzothiazole-2-yl) sulfide|Benzothiazole, 2-[(phenylmethyl)thio]-|NCGC00327389-01|BAS 00920100|J1.099.837I|10.14272/JFRIJTKSNFXTIR-UHFFFAOYSA-N|AB01322328-02|doi:10.14272/JFRIJTKSNFXTIR-UHFFFAOYSA-N|F1216-0217
| Molecular Formula | C14H11NS2 |
|---|---|
| Molecular Weight | 257.0333 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.0333 |
| Monoisotopic Mass | 257.0333 |
| Heavy Atoms | 17 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 19654-17-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3S2 |
| InChIKey | JFRIJTKSNFXTIR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Benzylsulfanyl)-1,3-benzothiazole (CAS 19654-17-2), with molecular formula C14H11NS2 and molecular weight 257.0333 g/mol. IUPAC: 2-benzylsulfanyl-1,3-benzothiazole.