2-Pyridinecarboxylic acid, 6-[8-[(2-benzothiazolylamino)carbonyl]-3,4-dihydro-2(1H)-isoquinolinyl]-3-bromo-, 1,1-dimethylethyl ester structure
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Common Name | 2-Pyridinecarboxylic acid, 6-[8-[(2-benzothiazolylamino)carbonyl]-3,4-dihydro-2(1H)-isoquinolinyl]-3-bromo-, 1,1-dimethylethyl ester | ||
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| CAS Number | 1235036-16-4 | Molecular Weight | 565.48100 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C27H25BrN4O3S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | tert-butyl 6-[8-(1,3-benzothiazol-2-ylcarbamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-bromopyridine-2-carboxylate |
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| Molecular Formula | C27H25BrN4O3S |
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| Molecular Weight | 565.48100 |
| Exact Mass | 564.08300 |
| PSA | 116.15000 |
| LogP | 6.67310 |
| InChIKey | MHSIKILHKGQXMY-UHFFFAOYSA-N |
| SMILES | CC(C)(C)OC(=O)c1nc(N2CCc3cccc(C(=O)Nc4nc5ccccc5s4)c3C2)ccc1Br |