2-{[1-(4-bromobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-[(2-methoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{[1-(4-bromobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-[(2-methoxyphenyl)methyl]acetamide
2-{[1-(4-bromobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-[(2-methoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | K653-0681 |
| Compound Name: | 2-{[1-(4-bromobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-[(2-methoxyphenyl)methyl]acetamide |
| Molecular Weight: | 546.46 |
| Molecular Formula: | C23 H20 Br N3 O4 S2 |
| Smiles: | COc1ccccc1CNC(CSc1nc2ccccc2n1S(c1ccc(cc1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3202 |
| logD: | 5.3202 |
| logSw: | -5.3288 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.966 |
| InChI Key: | KRLLICDLSGTGQH-UHFFFAOYSA-N |