{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[1-(4-methylpyrimidin-2-yl)piperidin-4-yl]methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[1-(4-methylpyrimidin-2-yl)piperidin-4-yl]methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[1-(4-methylpyrimidin-2-yl)piperidin-4-yl]methanone
Compound characteristics
| Compound ID: | L155-0155 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[1-(4-methylpyrimidin-2-yl)piperidin-4-yl]methanone |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C23 H29 N5 O3 |
| Smiles: | Cc1ccnc(n1)N1CCC(CC1)C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3064 |
| logD: | 1.8381 |
| logSw: | -2.702 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.732 |
| InChI Key: | DGWPDPDTLGKTTC-UHFFFAOYSA-N |