methyl 2-{2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
methyl 2-{2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamido}benzoate
methyl 2-{2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | Y510-4461 |
| Compound Name: | methyl 2-{2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 355.41 |
| Molecular Formula: | C18 H17 N3 O3 S |
| Smiles: | Cc1ccc2c(c1)nc([nH]2)SCC(Nc1ccccc1C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0378 |
| logD: | 3.0247 |
| logSw: | -3.3874 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.605 |
| InChI Key: | JSNVPUCVSWZZQB-UHFFFAOYSA-N |