1-{2-[(2-hydroxyethyl)amino]-1H-benzimidazol-1-yl}-3-methylbutan-2-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-{2-[(2-hydroxyethyl)amino]-1H-benzimidazol-1-yl}-3-methylbutan-2-one--hydrogen chloride (1/1)
1-{2-[(2-hydroxyethyl)amino]-1H-benzimidazol-1-yl}-3-methylbutan-2-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D379-0217 |
| Compound Name: | 1-{2-[(2-hydroxyethyl)amino]-1H-benzimidazol-1-yl}-3-methylbutan-2-one--hydrogen chloride (1/1) |
| Molecular Weight: | 297.78 |
| Molecular Formula: | C14 H19 N3 O2 |
| Salt: | HCl |
| Smiles: | CC(C)C(Cn1c2ccccc2nc1NCCO)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9098 |
| logD: | 1.9081 |
| logSw: | -2.2692 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.596 |
| InChI Key: | GQNBFCZYRZXMLG-UHFFFAOYSA-N |