1-{4-[(2-aminoethyl)(oxan-4-yl)amino]piperidin-1-yl}-2-(2-methylphenyl)ethan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-{4-[(2-aminoethyl)(oxan-4-yl)amino]piperidin-1-yl}-2-(2-methylphenyl)ethan-1-one--hydrogen chloride (1/1)
1-{4-[(2-aminoethyl)(oxan-4-yl)amino]piperidin-1-yl}-2-(2-methylphenyl)ethan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | SA68-0663 |
| Compound Name: | 1-{4-[(2-aminoethyl)(oxan-4-yl)amino]piperidin-1-yl}-2-(2-methylphenyl)ethan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 395.97 |
| Molecular Formula: | C21 H33 N3 O2 |
| Salt: | HCl |
| Smiles: | Cc1ccccc1CC(N1CCC(CC1)N(CCN)C1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4212 |
| logD: | -0.6894 |
| logSw: | -2.3123 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.303 |
| InChI Key: | OFXBXSIZVLBXPF-UHFFFAOYSA-N |