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| Duplicate ID | |
|---|---|
| Smiles | O=C(c1ccc(o1)S(=O)(=O)NCc1cccnc1)N1CCN(CC1)c1ccccc1F |
| Cas Number | 1172957-19-5 |
| InchiKey | JQXLTMARCDHEJY-UHFFFAOYSA-N |
| InChi | InChI=1S/C21H21FN4O4S/c22-17-5-1-2-6-18(17)25-10-12-26(13-11-25)21(27)19-7-8-20(30-19)31(28,29)24-15-16-4-3-9-23-14-16/h1-9,14,24H,10-13,15H2 |
| Formula | C21H21FN4O4S |
| Molecular weight | 444.479 |
| Rings | 4 |
| logP | 3.7292 |
| PSA | 104.13 |
| MR | 118.012 |