5-(2-{4-[(benzylamino)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-[(benzylamino)methyl]phenoxy}-1-hydroxyethyl)-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1)
5-(2-{4-[(benzylamino)methyl]phenoxy}-1-hydroxyethyl)-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D300-0265 |
| Compound Name: | 5-(2-{4-[(benzylamino)methyl]phenoxy}-1-hydroxyethyl)-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1) |
| Molecular Weight: | 453.97 |
| Molecular Formula: | C25 H27 N3 O3 |
| Salt: | HCl |
| Smiles: | CN1C(N(C)c2cc(ccc12)C(COc1ccc(CNCc2ccccc2)cc1)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9256 |
| logD: | 1.807 |
| logSw: | -3.3798 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.069 |
| InChI Key: | KIGAGINDZIJYTA-DEOSSOPVSA-N |