5,7-dibromo-6,6-dimethyl-1-phenyl-1,5,6,7-tetrahydro-4H-indazol-4-one
Chemical Structure Depiction of
5,7-dibromo-6,6-dimethyl-1-phenyl-1,5,6,7-tetrahydro-4H-indazol-4-one
5,7-dibromo-6,6-dimethyl-1-phenyl-1,5,6,7-tetrahydro-4H-indazol-4-one
Compound characteristics
| Compound ID: | 8006-3339 |
| Compound Name: | 5,7-dibromo-6,6-dimethyl-1-phenyl-1,5,6,7-tetrahydro-4H-indazol-4-one |
| Molecular Weight: | 398.09 |
| Molecular Formula: | C15 H14 Br2 N2 O |
| Smiles: | CC1(C)C(C(c2cnn(c3ccccc3)c2C1[Br])=O)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8304 |
| logD: | 4.8304 |
| logSw: | -4.5076 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 27.0114 |
| InChI Key: | CGVHERGYTFJMDT-UHFFFAOYSA-N |