N-(4-bromo-3-methylphenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide--hydrogen chloride (1/1)
N-(4-bromo-3-methylphenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 4239-0046 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide--hydrogen chloride (1/1) |
| Molecular Weight: | 406.75 |
| Molecular Formula: | C16 H24 Br N3 O2 |
| Salt: | HCl |
| Smiles: | Cc1cc(ccc1[Br])NC(CCN1CCN(CC1)CCO)=O |
| Stereo: | ACHIRAL |
| logP: | 1.761 |
| logD: | 1.565 |
| logSw: | -2.279 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.545 |
| InChI Key: | VOLNJKLUYCOPTH-UHFFFAOYSA-N |