5-(2-{4-[(cyclooctylamino)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-[(cyclooctylamino)methyl]phenoxy}-1-hydroxyethyl)-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1)
5-(2-{4-[(cyclooctylamino)methyl]phenoxy}-1-hydroxyethyl)-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D300-0324 |
| Compound Name: | 5-(2-{4-[(cyclooctylamino)methyl]phenoxy}-1-hydroxyethyl)-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1) |
| Molecular Weight: | 474.04 |
| Molecular Formula: | C26 H35 N3 O3 |
| Salt: | HCl |
| Smiles: | CN1C(N(C)c2cc(ccc12)C(COc1ccc(CNC2CCCCCCC2)cc1)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0209 |
| logD: | 1.9764 |
| logSw: | -4.079 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.916 |
| InChI Key: | KNDJSMJRIRGIAM-VWLOTQADSA-N |