tert-butyl 2-{[3-(1,3-benzothiazol-2-yl)-2-oxo-2H-chromen-7-yl]oxy}acetate
tert-butyl 2-[3-(1,3-benzothiazol-2-yl)-2-oxochromen-7-yl]oxyacetate
Also Known As: CBMicro_002261|Oprea1_763898|NCGC00315110-01|BIM-0002449.P001|UPCMLD0ENAT0504-6790:001|AB00140474-03|SR-01000456876-1|tert-butyl 2-{[3-(1,3-benzothiazol-2-yl)-2-oxo-2H-chromen-7-yl]oxy}acetate|F0821-0186|tert-butyl {[3-(1,3-benzothiazol-2-yl)-2-oxo-2H-chromen-7-yl]oxy}acetate|tert-butyl 2-((3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl)oxy)acetate|tert-butyl 2-[3-(1,3-benzothiazol-2-yl)-2-oxochromen-7-yl]oxyacetate|tert-butyl 2-(3-benzothiazol-2-yl-2-oxochromen-7-yloxy)acetate|TERT-BUTYL ((3-(1,3-BENZOTHIAZOL-2-YL)-2-OXO-2H-CHROMEN-7-YL)OXY)ACETATE
| Molecular Formula | C22H19NO5S |
|---|---|
| Molecular Weight | 409.0984 g/mol |
| LogP | 4.7902 |
| Topological Polar Surface Area | 78.63 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.0984 |
| Monoisotopic Mass | 409.0984 |
| Heavy Atoms | 29 |
| Complexity | 1232.6589 |
Chemical Identifiers
| CAS Number | 315237-67-3 |
|---|---|
| SMILES | CC(C)(C)OC(=O)COC1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=CC=CC=C4S3 |
Product Overview
tert-butyl 2-{[3-(1,3-benzothiazol-2-yl)-2-oxo-2H-chromen-7-yl]oxy}acetate (CAS 315237-67-3), with molecular formula C22H19NO5S and molecular weight 409.0984 g/mol. IUPAC: tert-butyl 2-[3-(1,3-benzothiazol-2-yl)-2-oxochromen-7-yl]oxyacetate.