1-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]-3,3-dimethylbutan-2-one--hydrogen bromide (1/1)
Chemical Structure Depiction of
1-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]-3,3-dimethylbutan-2-one--hydrogen bromide (1/1)
1-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]-3,3-dimethylbutan-2-one--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 2949-0012 |
| Compound Name: | 1-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]-3,3-dimethylbutan-2-one--hydrogen bromide (1/1) |
| Molecular Weight: | 357.31 |
| Molecular Formula: | C15 H20 N2 O S |
| Salt: | HBr |
| Smiles: | Cc1cc2c(cc1C)[nH]c(n2)SCC(C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1813 |
| logD: | 4.1806 |
| logSw: | -4.2237 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.4984 |
| InChI Key: | SFIISOWJHAYNEE-UHFFFAOYSA-N |