5-[2-(4-{[(adamantan-1-yl)amino]methyl}phenoxy)-1-hydroxyethyl]-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-[2-(4-{[(adamantan-1-yl)amino]methyl}phenoxy)-1-hydroxyethyl]-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1)
5-[2-(4-{[(adamantan-1-yl)amino]methyl}phenoxy)-1-hydroxyethyl]-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D300-0268 |
| Compound Name: | 5-[2-(4-{[(adamantan-1-yl)amino]methyl}phenoxy)-1-hydroxyethyl]-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1) |
| Molecular Weight: | 498.07 |
| Molecular Formula: | C28 H35 N3 O3 |
| Salt: | HCl |
| Smiles: | CN1C(N(C)c2cc(ccc12)C(COc1ccc(CNC23CC4CC(CC(C4)C3)C2)cc1)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1014 |
| logD: | 2.5741 |
| logSw: | -4.2782 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.555 |
| InChI Key: | OQKDRHZLAQFKGT-DRBBDDIUSA-N |