2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[5-(4-nitrobenzene-1-sulfonyl)-1,3-thiazol-2-yl]acetamide
Chemical Structure Depiction of
2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[5-(4-nitrobenzene-1-sulfonyl)-1,3-thiazol-2-yl]acetamide
2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[5-(4-nitrobenzene-1-sulfonyl)-1,3-thiazol-2-yl]acetamide
Compound characteristics
| Compound ID: | 6438-0094 |
| Compound Name: | 2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[5-(4-nitrobenzene-1-sulfonyl)-1,3-thiazol-2-yl]acetamide |
| Molecular Weight: | 489.55 |
| Molecular Formula: | C19 H15 N5 O5 S3 |
| Smiles: | Cc1ccc2c(c1)nc([nH]2)SCC(Nc1ncc(s1)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7441 |
| logD: | 3.7407 |
| logSw: | -3.7848 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 114.58 |
| InChI Key: | BSRLUGGJJNENQH-UHFFFAOYSA-N |