(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-4-methylpyrimidin-5-yl)[4-(4-chlorophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-4-methylpyrimidin-5-yl)[4-(4-chlorophenyl)piperazin-1-yl]methanone
(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-4-methylpyrimidin-5-yl)[4-(4-chlorophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | G415-4570 |
| Compound Name: | (2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-4-methylpyrimidin-5-yl)[4-(4-chlorophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 465.94 |
| Molecular Formula: | C24 H24 Cl N5 O3 |
| Smiles: | Cc1c(cnc(NCc2ccc3c(c2)OCO3)n1)C(N1CCN(CC1)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5833 |
| logD: | 3.5833 |
| logSw: | -3.9165 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.301 |
| InChI Key: | LLDOALGJIFZOPQ-UHFFFAOYSA-N |