1-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]ethan-1-one--hydrogen bromide (1/1)
Chemical Structure Depiction of
1-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]ethan-1-one--hydrogen bromide (1/1)
1-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]ethan-1-one--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 2949-0014 |
| Compound Name: | 1-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]ethan-1-one--hydrogen bromide (1/1) |
| Molecular Weight: | 491.49 |
| Molecular Formula: | C24 H30 N2 O2 S |
| Salt: | HBr |
| Smiles: | Cc1ccc2c(c1)nc([nH]2)SCC(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.074 |
| logD: | 6.0672 |
| logSw: | -5.2214 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.706 |
| InChI Key: | JMXMHKCMUUCHTP-UHFFFAOYSA-N |