N-(3-{2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamido}phenyl)adamantane-1-carboxamide
Chemical Structure Depiction of
N-(3-{2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamido}phenyl)adamantane-1-carboxamide
N-(3-{2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamido}phenyl)adamantane-1-carboxamide
Compound characteristics
| Compound ID: | Y510-4392 |
| Compound Name: | N-(3-{2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamido}phenyl)adamantane-1-carboxamide |
| Molecular Weight: | 490.62 |
| Molecular Formula: | C27 H30 N4 O3 S |
| Smiles: | COc1ccc2c(c1)nc([nH]2)SCC(Nc1cccc(c1)NC(C12CC3CC(CC(C3)C2)C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4171 |
| logD: | 5.4164 |
| logSw: | -5.4687 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.798 |
| InChI Key: | BIYOOQOSTQULGA-UHFFFAOYSA-N |