5-bromo-1-(3,3-dimethyl-2-oxobutyl)-1H-indole-2,3-dione
Chemical Structure Depiction of
5-bromo-1-(3,3-dimethyl-2-oxobutyl)-1H-indole-2,3-dione
5-bromo-1-(3,3-dimethyl-2-oxobutyl)-1H-indole-2,3-dione
Compound characteristics
| Compound ID: | K029-0039 |
| Compound Name: | 5-bromo-1-(3,3-dimethyl-2-oxobutyl)-1H-indole-2,3-dione |
| Molecular Weight: | 324.17 |
| Molecular Formula: | C14 H14 Br N O3 |
| Smiles: | CC(C)(C)C(CN1C(C(c2cc(ccc12)[Br])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9326 |
| logD: | 2.9326 |
| logSw: | -3.4338 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.372 |
| InChI Key: | HGVKDWHSABRNMY-UHFFFAOYSA-N |