N-(3-{2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamido}phenyl)adamantane-1-carboxamide
Chemical Structure Depiction of
N-(3-{2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamido}phenyl)adamantane-1-carboxamide
N-(3-{2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamido}phenyl)adamantane-1-carboxamide
Compound characteristics
| Compound ID: | Y510-4391 |
| Compound Name: | N-(3-{2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamido}phenyl)adamantane-1-carboxamide |
| Molecular Weight: | 474.62 |
| Molecular Formula: | C27 H30 N4 O2 S |
| Smiles: | Cc1ccc2c(c1)nc([nH]2)SCC(Nc1cccc(c1)NC(C12CC3CC(CC(C3)C2)C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8341 |
| logD: | 5.8338 |
| logSw: | -5.435 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.254 |
| InChI Key: | ITNBJMJWSHEMRC-UHFFFAOYSA-N |