2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-(1-benzylpiperidin-4-yl)-4-methylpyrimidine-5-carboxamide
Chemical Structure Depiction of
2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-(1-benzylpiperidin-4-yl)-4-methylpyrimidine-5-carboxamide
2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-(1-benzylpiperidin-4-yl)-4-methylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | G415-4638 |
| Compound Name: | 2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-(1-benzylpiperidin-4-yl)-4-methylpyrimidine-5-carboxamide |
| Molecular Weight: | 459.55 |
| Molecular Formula: | C26 H29 N5 O3 |
| Smiles: | Cc1c(cnc(NCc2ccc3c(c2)OCO3)n1)C(NC1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2201 |
| logD: | 1.7749 |
| logSw: | -3.4689 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.072 |
| InChI Key: | YWUMCACOIJFJHU-UHFFFAOYSA-N |