3-[4-(2-methylpropoxy)phenyl]-6-{3-oxo-3-[4-(propan-2-yl)piperazin-1-yl]propyl}-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
3-[4-(2-methylpropoxy)phenyl]-6-{3-oxo-3-[4-(propan-2-yl)piperazin-1-yl]propyl}-1,2,4-triazin-5(2H)-one
3-[4-(2-methylpropoxy)phenyl]-6-{3-oxo-3-[4-(propan-2-yl)piperazin-1-yl]propyl}-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | V025-2680 |
| Compound Name: | 3-[4-(2-methylpropoxy)phenyl]-6-{3-oxo-3-[4-(propan-2-yl)piperazin-1-yl]propyl}-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 427.55 |
| Molecular Formula: | C23 H33 N5 O3 |
| Salt: | not_available |
| Smiles: | CC(C)COc1ccc(cc1)C1NN=C(CCC(N2CCN(CC2)C(C)C)=O)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4457 |
| logD: | 2.4457 |
| logSw: | -2.7317 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.064 |
| InChI Key: | LJXKVHGHCCYWSX-UHFFFAOYSA-N |