5,5-dibromo-3,6,6-trimethyl-1-(pyridin-2-yl)-1,5,6,7-tetrahydro-4H-indazol-4-one
Chemical Structure Depiction of
5,5-dibromo-3,6,6-trimethyl-1-(pyridin-2-yl)-1,5,6,7-tetrahydro-4H-indazol-4-one
5,5-dibromo-3,6,6-trimethyl-1-(pyridin-2-yl)-1,5,6,7-tetrahydro-4H-indazol-4-one
Compound characteristics
| Compound ID: | 8015-7275 |
| Compound Name: | 5,5-dibromo-3,6,6-trimethyl-1-(pyridin-2-yl)-1,5,6,7-tetrahydro-4H-indazol-4-one |
| Molecular Weight: | 413.11 |
| Molecular Formula: | C15 H15 Br2 N3 O |
| Smiles: | Cc1c2C(C(C(C)(C)Cc2n(c2ccccn2)n1)([Br])[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8988 |
| logD: | 3.8911 |
| logSw: | -4.238 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.22 |
| InChI Key: | FLLXVLJOQJIEMS-UHFFFAOYSA-N |